SCHEMBL7425465

SCHEMBL7425465

CCOC(=O)c1cc2ccccc2n1CC(=O)O

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.79
KMT2A Q03164 1/20 0.79
NOD2 Q9HC29 6/20 0.67
NOD1 Q9Y239 6/20 0.67
SMN1; SMN2 Q16637 2/20 0.64
KDM4E B2RXH2 1/20 0.64
CRHBP P24387 1/20 0.64
CRHR2 Q13324 1/20 0.64
POLB P06746 3/20 0.61
F10 P00742 2/20 0.59
L3MBTL1 Q9Y468 1/20 0.54
TSHR P16473 3/20 0.52
ALDH1A1 P00352 3/20 0.52
HPGD P15428 1/20 0.52
CCR2 P41597 1/20 0.50
MTNR1A P48039 1/20 0.49
MTNR1B P49286 1/20 0.49
MAPT P10636 1/20 0.48
ATM Q13315 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL16201674 0.89 MEN1 (0.74) MEN1KMT2ANOD2NOD1SMN1; SMN2
SCHEMBL18202169 0.89 MEN1 (0.74) MEN1KMT2ANOD2NOD1SMN1; SMN2
SCHEMBL7423741 0.88 KMT2A (0.73) MEN1KMT2ANOD2NOD1SMN1; SMN2
SCHEMBL3259707 0.87 NOD2 (0.71) MEN1KMT2ANOD2NOD1SMN1; SMN2
SCHEMBL10629278 0.86 KMT2A (0.71) MEN1KMT2ANOD2NOD1SMN1; SMN2
SCHEMBL28669136 0.86 NOD2 (0.70) MEN1KMT2ANOD2NOD1SMN1; SMN2
SCHEMBL14994342 0.85 MEN1 (0.70) MEN1KMT2ANOD2NOD1SMN1; SMN2
SCHEMBL4798323 0.85 NOD2 (0.85) MEN1KMT2ANOD2NOD1SMN1; SMN2
SCHEMBL8694830 0.85 MEN1 (0.69) MEN1KMT2ANOD2NOD1SMN1; SMN2
SCHEMBL8686408 0.84 SMN1; SMN2 (0.68) MEN1KMT2ANOD2NOD1SMN1; SMN2

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2785720-B1 HETEROCYCLIC AMIDES COMPOUNDS WHICH ARE HDAC6 INHIBITORS AND USED AS ANTI-TUMORAL AGENTS NANJING ALLGEN PHARMA CO LTD (CN) 2017-08-09 EP disclosed
EP-2785720-B1 HETEROCYCLIC AMIDES COMPOUNDS WHICH ARE HDAC6 INHIBITORS AND USED AS ANTI-TUMORAL AGENTS NANJING ALLGEN PHARMA CO LTD (CN) 2017-08-09 EP disclosed
US-9345905-B2 Heterocyclic amides compounds which are HDAC6 inhibitors and used as anti-tumoral agents NANJING ALLGEN PHARMA CO. LTD. (CN) 2016-05-24 US disclosed
US-9345905-B2 Heterocyclic amides compounds which are HDAC6 inhibitors and used as anti-tumoral agents NANJING ALLGEN PHARMA CO. LTD. (CN) 2016-05-24 US disclosed
US-9345905-B2 Heterocyclic amides compounds which are HDAC6 inhibitors and used as anti-tumoral agents NANJING ALLGEN PHARMA CO. LTD. (CN) 2016-05-24 US disclosed
US-20140322229-A1 HETEROCYCLIC AMIDES COMPOUNDS WHICH ARE HDAC6 INHIBITORS AND USED AS ANTI-TUMORAL AGENTS BETA PHARMA CANADA INC. (CA) 2014-10-30 US disclosed
US-20140322229-A1 HETEROCYCLIC AMIDES COMPOUNDS WHICH ARE HDAC6 INHIBITORS AND USED AS ANTI-TUMORAL AGENTS BETA PHARMA CANADA INC. (CA) 2014-10-30 US disclosed
US-20140322229-A1 HETEROCYCLIC AMIDES COMPOUNDS WHICH ARE HDAC6 INHIBITORS AND USED AS ANTI-TUMORAL AGENTS BETA PHARMA CANADA INC. (CA) 2014-10-30 US disclosed
EP-2785720-A1 HETEROCYCLIC AMIDES COMPOUNDS WHICH ARE HDAC6 INHIBITORS AND USED AS ANTI-TUMORAL AGENTS Beta Pharma Canada Inc. (CA) 2014-10-08 EP disclosed
CN-103974956-A Heterocyclic amides compounds which are hdac6 inhibitors and used as anti-tumoral agents BETA PHARMA CANADA INC 2014-08-06 CN disclosed
WO-2013078544-A1 HETEROCYCLIC AMIDES COMPOUNDS WHICH ARE HDAC6 INHIBITORS AND USED AS ANTI-TUMORAL AGENTS BETA PHARMA CANADA INC. (CA) 2013-06-06 WO disclosed
WO-2013078544-A1 HETEROCYCLIC AMIDES COMPOUNDS WHICH ARE HDAC6 INHIBITORS AND USED AS ANTI-TUMORAL AGENTS BETA PHARMA CANADA INC. (CA) 2013-06-06 WO disclosed
US-6337344-B1 ANTICOAGULANTS AND ENZYME INHIBITORS FOR CARDIOVASCULAR DISORDERS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-01-08 US disclosed
EP-1042287-A1 INDOLE DERIVATIVES AS INHIBITORS OF FACTOR XA Aventis Pharma Deutschland GmbH (DE) 2000-10-11 EP disclosed
WO-1999033800-A1 INDOLE DERIVATIVES AS INHIBITORS OR FACTOR XA AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 1999-07-08 WO disclosed
US-5760032-A GASTROINTESTINAL DISORDERS AND NERVOUS SYSTEM DISORDERS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1998-06-02 US disclosed
EP-0776892-A1 THIENYLAZOLE COMPOUND AND THIENOTRIAZOLODIAZEPINE COMPOUND YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-06-04 EP 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 (1 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-20140322229-A1 HETEROCYCLIC AMIDES COMPOUNDS WHICH ARE HDAC6 INHIBITORS AND USED AS ANTI-TUMORAL AGENTS HDAC6, HDAC1, HDAC7 MEN1 2230/4885KMT2A 369/4885NOD2 1663/4885

“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.