SCHEMBL658106

SCHEMBL658106

O=C(COc1ccc(Cl)cc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.64
NPC1 O15118 2/20 0.64
RAB9A P51151 2/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
KMT2A Q03164 4/20 0.62
L3MBTL1 Q9Y468 5/20 0.58
LMNA P02545 3/20 0.58
MEN1 O00255 2/20 0.58
HPGD P15428 1/20 0.58
KDM4E B2RXH2 2/20 0.55
MAPK1 P28482 1/20 0.55
CASP3 P42574 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
SENP6 Q9GZR1 1/20 0.55
MRGPRX4 Q96LA9 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL6205126 0.93 L3MBTL1 (0.60) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL6325847 0.91 MAPT (0.64) MAPTNPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL9786970 0.91 MAPT (0.74) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL27628199 0.90 MAPT (0.73) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL9786937 0.88 NR4A2 (0.66) MAPTNPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL1068092 0.87 MAPT (0.69) MAPTNPC1RAB9ASMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL8136104 0.85 MAPT (0.67) MAPTNPC1RAB9ASMN1; SMN2KMT2A
Methane SCHEMBL28765047 0.85 MAPT (0.67) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL9368178 0.85 RAB9A (0.52) MAPTNPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL3868073 0.84 MAPT (0.63) MAPTNPC1RAB9AL3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2836497-B1 CATALYST COMPOUNDS UNIV LIVERPOOL (GB) 2016-03-23 EP disclosed
EP-2349999-B1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIV SAARLAND (DE) 2016-01-27 EP disclosed
US-9212199-B2 Catalyst compounds THE UNIVERSITY OF LIVERPOOL (GB) 2015-12-15 US disclosed
US-9212199-B2 Catalyst compounds THE UNIVERSITY OF LIVERPOOL (GB) 2015-12-15 US disclosed
US-20150080592-A1 CATALYST COMPOUNDS THE UNIVERSITY OF LIVERPOOL (GB) 2015-03-19 US disclosed
US-20150080592-A1 CATALYST COMPOUNDS THE UNIVERSITY OF LIVERPOOL (GB) 2015-03-19 US disclosed
US-8912186-B2 Allosteric protein kinase modulators UNIVERSITAET DES SAARLANDES (DE) 2014-12-16 US disclosed
WO-2013153407-A1 CATALYST COMPOUNDS THE UNIVERSITY OF LIVERPOOL (GB) 2013-10-17 WO disclosed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US disclosed
US-8012901-B1 Method of synthesizing enantiopure mexiletine analogues and novel β-thiophenoxy and pyridyl ethers NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-09-06 US disclosed
US-4957934-A AROMATASE INHIBITORS, TREATMENT OF STEROID HORMONE DEPENDENT DISEASES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-09-18 US disclosed
CN-1008735-B Pyrrole ylmethyl-cyclopropyl-carbinol derivatives with replacement is a composition of active components BAYER AG (DE) 1990-07-11 CN disclosed
US-4921528-A PLANT GROWTH REGULATORS, FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1990-05-01 US disclosed
CN-85108725-A The preparation method and the application thereof of the pyrroles's methyl-cyclopropyl-carbinol derivatives that replaces 1986-05-10 CN disclosed
EP-0180136-A2 Substituted azolylmethyl-cyclopropyl carbinol derivatives BAYER AG (DE) 1986-05-07 EP disclosed
US-4212865-A BACTERICIDES RIKER LABORATORIES, INC. (US) 1980-07-15 US disclosed
US-4190590-A DISINFECTING AND STERILIZING DENTAL AND MEDICAL EQUIPMENT RIKER LABORATORIES, INC. (US) 1980-02-26 US disclosed
US-4124602-A OPTIONALLY SUBSTITUTED 3-(CYANOPHENYL)BENZOFURANS RIKER LABORATORIES, INC. (US) 1978-11-07 US disclosed
US-4048323-A Antimicrobial (2-nitro-3-benzofuranyl)-benzoic acids RIKER LABORATORIES, INC. (US) 1977-09-13 US disclosed
US-3952002-A FUNGICIDE, MICROBIOCIDE BAYER AKTIENGESELLSCHAFT (DT) 1976-04-20 US 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 (2 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-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS AURKC, AURKA, AURKB MAPT 964/4885NPC1 2687/4885RAB9A 2902/4885
US-20150080592-A1 CATALYST COMPOUNDS IDH3B, IDH2, NQO1 MAPT 4290/4885NPC1 2868/4885RAB9A 857/4885

“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.