SCHEMBL4567595

SCHEMBL4567595

O=C1CNC(=O)c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.61
▸ CA9 Q16790 1/20 0.61
▸ GSK3B P49841 1/20 0.50
▸ CLK4 Q9HAZ1 3/20 0.48
▸ DYRK1B Q9Y463 2/20 0.48
▸ CDK5 Q00535 2/20 0.48
▸ DYRK1A Q13627 2/20 0.48
▸ PIM1 P11309 1/20 0.48
▸ CSNK1A1 P48729 1/20 0.48
▸ ROCK1 Q13464 1/20 0.48
▸ LRRK2 Q5S007 1/20 0.48
▸ PARP1 P09874 3/20 0.47
▸ HPGD P15428 1/20 0.47
▸ PARP10 Q53GL7 2/20 0.47
▸ PARP11 Q9NR21 2/20 0.47
▸ PDPK1 O15530 1/20 0.47
▸ TYRO3 Q06418 1/20 0.44
▸ NTRK2 Q16620 1/20 0.44
▸ CASP3 P42574 1/20 0.43
▸ CASP2 P42575 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17257956 0.77 CA12 (0.42) CA12CA9GSK3BDYRK1BLRRK2
SCHEMBL3296103 0.77 PARP11 (0.64) CA12CA9GSK3BPARP1HPGD
SCHEMBL3918073 0.77 CA12 (0.83) CA12CA9GSK3BCLK4DYRK1B
SCHEMBL442677 0.77 GSK3B (0.57) CA12CA9GSK3BCLK4DYRK1B
SCHEMBL68595 0.76 CA12 (0.45) CA12CA9GSK3BDYRK1BLRRK2
SCHEMBL4818277 0.76 CA12 (1.00) CA12CA9GSK3BCLK4DYRK1B
SCHEMBL14896 0.76 CA12 (1.00) CA12CA9GSK3BCLK4DYRK1B
SCHEMBL29355184 0.76 CA12 (1.00) CA12CA9GSK3BCLK4DYRK1B
SCHEMBL22313400 0.76 PARP11 (0.62) CA12CA9GSK3BPARP1HPGD
SCHEMBL8213866 0.74 CA12 (0.95) CA12CA9GSK3BCLK4DYRK1B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230175036-A1 SELF-IMMOLATIVE PROBES FOR ENZYME ACTIVITY DETECTION ENZO LIFE SCIENCES, INC. (US) 2023-06-08 — — US disclosed
US-11661621-B2 Self-immolative probes for enzyme activity detection ENZO LIFE SCIENCES, INC. (US) 2023-05-30 — — US disclosed
US-20180223328-A1 COMPOUNDS AND METHODS FOR DETECTION OF ENZYMES THAT REMOVE FORMYL, SUCCINYL, METHYL SUCCINYL OR MYRISTOYL GROUPS FROM EPSILON-AMINO LYSINE MOIETIES ENZO LIFE SCIENCES, INC. (US) 2018-08-09 — — US disclosed
US-20180127456-A1 MULTISIGNAL LABELING REAGENTS AND PROCESSES AND USES THEREFOR Enzo Life Science, Inc., c/o Enzo Biochem, Inc. (US) 2018-05-10 — — US disclosed
US-20180127455-A1 MULTISIGNAL LABELING REAGENTS AND PROCESSES AND USES THEREFOR Enzo Life Science, Inc., c/o Enzo Biochem, Inc. (US) 2018-05-10 — — US disclosed
US-9963734-B2 Compounds and methods for detection of enzymes that remove formyl, succinyl, methyl succinyl or myristoyl groups from epsilon-amino lysine moieties ENZO LIFE SCIENCES, INC. (US) 2018-05-08 — — US disclosed
US-20170198333-A1 COMPOUNDS AND METHODS FOR DETECTION OF ENZYMES THAT REMOVE FORMYL, SUCCINYL, METHYL SUCCINYL OR MYRISTOYL GROUPS FROM EPSILON-AMINO LYSINE MOIETIES ENZO LIFE SCIENCES, INC. (US) 2017-07-13 — — US disclosed
US-9664696-B1 Compounds for determining the presence of hydrogen sulfide and methods of use UNIVERSITY OF OREGON (US) 2017-05-30 — — US disclosed
US-20170137863-A1 Self-Immolative Probes for Enzyme Activity Detection ENZO LIFE SCIENCES, INC., C/O ENZO BIOCHEM, INC. (US) 2017-05-18 — — US disclosed
US-9637773-B2 Compounds and methods for detection of enzymes that remove formyl, succinyl, methyl succinyl or myristoyl groups from ε-amino lysine moieties ENZO LIFE SCIENCES, INC. (US) 2017-05-02 — — US disclosed
US-20120122136-A1 Self-immolative probes for enzyme activity detection ENZO LIFE SCIENCES, INC., C/O ENZO BIOCHEM, INC. (US) 2012-05-17 — — US disclosed
US-20120040380-A1 OPTICALLY-DETECTABLE ENZYME SUBSTRATES AND THEIR METHOD OF USE Life Technologies Corporation (US) 2012-02-16 — — US disclosed
US-20110318788-A1 Multisignal labeling reagents and processes and uses therefor ENZO LIFE SCIENCES, INC., C/O ENZO BIOCHEM, INC. (US) 2011-12-29 — — US disclosed
US-8039506-B2 Bicyclic lactam factor VIIa inhibitors useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2011-10-18 — — US disclosed
US-8039506-B2 Bicyclic lactam factor VIIa inhibitors useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2011-10-18 — — US disclosed
US-7893071-B2 Substituted phthalimide and isoquinoline derivatives; thalidomide analogs that lack the piperidine-2,6-dione moiety of thalidomide UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2011-02-22 — — US disclosed
US-20100041664-A1 BICYCLIC LACTAM FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY 2010-02-18 — — US disclosed
US-20100041664-A1 BICYCLIC LACTAM FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY 2010-02-18 — — US disclosed
WO-2005013914-A2 HETEROARYLAMINOSULFONYLPHENYL DERIVATIVES FOR USE AS SODIUM OR CALCIUM CHANNEL BLOCKERS IN THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2005-02-17 — — WO disclosed
WO-1994027969-A1 ISOQUINOLINETRIONE DERIVATIVES AS HERBICIDES ZENECA LIMITED (GB) 1994-12-08 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110318788-A1 Multisignal labeling reagents and processes and uses therefor PCNA, LIG4, LIG1 CA12 4680/4885CA9 4884/4885GSK3B 2418/4885
US-20100041664-A1 BICYCLIC LACTAM FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS F7, F8, F9 CA12 1594/4885CA9 656/4885GSK3B 388/4885
US-20120122136-A1 Self-immolative probes for enzyme activity detection SORD, SI, IMMT CA12 985/4885CA9 535/4885GSK3B 3005/4885
US-20230175036-A1 SELF-IMMOLATIVE PROBES FOR ENZYME ACTIVITY DETECTION SORD, SI, IMMT CA12 985/4885CA9 535/4885GSK3B 3005/4885
US-11661621-B2 Self-immolative probes for enzyme activity detection MGAM, SI, ENGASE CA12 637/4885CA9 499/4885GSK3B 3592/4885
US-20180223328-A1 COMPOUNDS AND METHODS FOR DETECTION OF ENZYMES THAT REMOVE FORMYL, SUCCINYL, METHYL SUCCINYL OR MYRISTOYL GROUPS FROM EPSILON-AMINO LYSINE MOIETIES EMG1, SPR, SHMT1 CA12 2706/4885CA9 2056/4885GSK3B 3065/4885
US-20170137863-A1 Self-Immolative Probes for Enzyme Activity Detection MGAM, SI, ENGASE CA12 637/4885CA9 499/4885GSK3B 3592/4885
US-20180127455-A1 MULTISIGNAL LABELING REAGENTS AND PROCESSES AND USES THEREFOR PCNA, LIG4, LIG1 CA12 4680/4885CA9 4884/4885GSK3B 2418/4885
US-20170198333-A1 COMPOUNDS AND METHODS FOR DETECTION OF ENZYMES THAT REMOVE FORMYL, SUCCINYL, METHYL SUCCINYL OR MYRISTOYL GROUPS FROM EPSILON-AMINO LYSINE MOIETIES EMG1, SPR, SHMT1 CA12 2706/4885CA9 2056/4885GSK3B 3065/4885
US-20180127456-A1 MULTISIGNAL LABELING REAGENTS AND PROCESSES AND USES THEREFOR PCNA, LIG4, LIG1 CA12 4680/4885CA9 4884/4885GSK3B 2418/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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