SCHEMBL7465717

SCHEMBL7465717

N#CC(=Cc1cccc2cnccc12)C(=O)NCc1ccc(O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
HSP90AA1 P07900 1/20 0.52
EGFR P00533 2/20 0.51
ERBB2 P04626 1/20 0.51
HTT P42858 1/20 0.47
PKM P14618 1/20 0.47
GPR55 Q9Y2T6 1/20 0.47
PLIN1 O60240 1/20 0.46
LMNA P02545 1/20 0.46
PLIN5 Q00G26 1/20 0.46
ABHD5 Q8WTS1 1/20 0.46
HPGD P15428 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
ROS1 P08922 1/20 0.45
RPS6KB1 P23443 1/20 0.45
MAPK1 P28482 1/20 0.45
PIP4K2A P48426 1/20 0.45
USP9X Q93008 1/20 0.44

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
SCHEMBL7460265 0.92 LMNA (0.57) MEN1KMT2AEGFRERBB2HTT
SCHEMBL7456816 0.90 BCL2A1 (0.48) MEN1KMT2AEGFRERBB2HTT
SCHEMBL7455893 0.84 MAPT (0.55) MEN1KMT2AHTTPKMLMNA
SCHEMBL7466157 0.82 TRPV1 (0.55) MEN1KMT2AHSP90AA1EGFRERBB2
SCHEMBL7457358 0.78 MEN1 (0.60) MEN1KMT2AHSP90AA1EGFRERBB2
SCHEMBL7472490 0.78 KMT2A (0.61) MEN1KMT2AEGFRERBB2PKM
SCHEMBL7464750 0.77 KDM4E (0.54) MEN1KMT2AEGFRERBB2HTT
SCHEMBL7464747 0.77 KDM4E (0.54) MEN1KMT2AEGFRERBB2HTT
SCHEMBL7459907 0.76 EGFR (0.57) MEN1KMT2AHSP90AA1EGFRERBB2
SCHEMBL7470342 0.74 MEN1 (0.60) MEN1KMT2AHSP90AA1EGFRERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0700388-B1 SUBSTITUTED BETA-ARYL AND BETA-HETEROARYL-ALPHA-CYANOACRYLAMIDE DERIVATIVES AS TYROSINE KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2002-09-18 EP claimed
EP-0700388-A1 SUBSTITUTED BETA-ARYL AND BETA-HETEROARYL-ALPHA-CYANOACRYLAMIDE DERIVATIVES AS TYROSINE KINASE INHIBITORS PHARMACIA & UPJOHN S.p.A. (IT) 1996-03-13 EP claimed
WO-1995026341-A1 SUBSTITUTED BETA-ARYL AND BETA-HETEROARYL-ALPHA-CYANOACRYLAMIDE DERIVATIVES AS TYROSINE KINASE INHIBITORS PHARMACIA S.P.A. (IT) 1995-10-05 WO claimed
EP-0700388-B1 SUBSTITUTED BETA-ARYL AND BETA-HETEROARYL-ALPHA-CYANOACRYLAMIDE DERIVATIVES AS TYROSINE KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2002-09-18 EP disclosed
US-5652250-A TYROSINE KINASE INHIBITORS PHARMACIA S.P.A. (IT) 1997-07-29 US disclosed
EP-0700388-A1 SUBSTITUTED BETA-ARYL AND BETA-HETEROARYL-ALPHA-CYANOACRYLAMIDE DERIVATIVES AS TYROSINE KINASE INHIBITORS PHARMACIA & UPJOHN S.p.A. (IT) 1996-03-13 EP disclosed
WO-1995026341-A1 SUBSTITUTED BETA-ARYL AND BETA-HETEROARYL-ALPHA-CYANOACRYLAMIDE DERIVATIVES AS TYROSINE KINASE INHIBITORS PHARMACIA S.P.A. (IT) 1995-10-05 WO disclosed