SCHEMBL7009985

SCHEMBL7009985

O=C(O)c1cn(Cc2ccccc2)c2c(F)c(F)c(F)cc2c1=O

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 5/20 0.61
LMNA P02545 1/20 0.59
MAPT P10636 1/20 0.55
TOP1 P11387 5/20 0.51
KDM4E B2RXH2 1/20 0.49

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
SCHEMBL7006634 0.90 CHRM1 (0.56) CHRM1LMNAMAPTTOP1KDM4E
SCHEMBL7010969 0.89 CHRM1 (0.52) CHRM1LMNAMAPTTOP1KDM4E
SCHEMBL8736415 0.84 CHRM1 (0.53) CHRM1LMNAMAPTTOP1
SCHEMBL3234394 0.82 CHRM1 (0.86) CHRM1LMNAMAPT
SCHEMBL7013056 0.82 KDM4E (0.60) CHRM1LMNAMAPTTOP1KDM4E
SCHEMBL30843076 0.82 KDM4E (0.61) LMNAKDM4E
SCHEMBL500816 0.82 KDM4E (0.61) LMNAKDM4E
SCHEMBL500481 0.82 KDM4E (0.69) CHRM1LMNATOP1KDM4E
SCHEMBL7011663 0.81 KDM4E (0.58) CHRM1LMNATOP1KDM4E
SCHEMBL21787284 0.81 TOP1 (0.68) CHRM1TOP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0614664-B2 Quinolonecarboxylic acid derivatives, their preparation and their use as cell adhesion inhibitors TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-01-08 EP disclosed
US-5889009-A ADMINISTERING 1,7-DISUBSTITUTED-4-OX-3-(QUINOLINECARBOXYLIC ACID OR NAPHTHYRIDINECARBOXYLIC ACID) TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-30 US disclosed
EP-0614664-B1 Quinolonecarboxylic acid derivatives, their preparation and their use as cell adhesion inhibitors TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-09-16 EP disclosed
US-5703081-A CELL ADHESION INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-12-30 US disclosed
US-5519024-A CELL ADHESION INHIBITOR TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-05-21 US disclosed
EP-0614664-A1 Quinolonecarboxylic acid derivatives, their preparation and their use as cell adhesion inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-09-14 EP disclosed