SCHEMBL9714348

SCHEMBL9714348

NC(=O)c1cn(Cc2ccccc2F)cn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 3/20 0.54
KDM5A P29375 2/20 0.54
KDM4A O75164 1/20 0.54
KDM4C Q9H3R0 1/20 0.54
CA5A P35218 1/20 0.44
ADA P00813 4/20 0.43
MAOB P27338 1/20 0.43
PARP15 Q460N3 1/20 0.43
PARP14 Q460N5 1/20 0.43
PARP10 Q53GL7 1/20 0.43
ALDH1A1 P00352 5/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
VNN1 O95497 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.40
SIRT1 Q96EB6 1/20 0.40
AURKA O14965 1/20 0.39
RPS6KB1 P23443 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL9714289 0.89 CA5A (0.45) KDM5BKDM5AKDM4AKDM4CCA5A
SCHEMBL9714146 0.84 CA5A (0.58) KDM5BKDM5AKDM4AKDM4CCA5A
SCHEMBL9714457 0.83 GRM2 (0.43) KDM5BKDM5AKDM4AKDM4CCA5A
SCHEMBL9714527 0.83 GRM2 (0.43) KDM5BKDM5AKDM4AKDM4CALDH1A1
SCHEMBL9714098 0.83 LMNA (0.50) KDM5BKDM5AKDM4CADALMNA
SCHEMBL9714504 0.83 CYP11B1 (0.47) KDM5BKDM5AKDM4AKDM4CADA
SCHEMBL10568691 0.82 KDM5A (0.51) KDM5BKDM5AKDM4AKDM4CALDH1A1
SCHEMBL15964744 0.79 RBP4 (0.54) KDM5BKDM5AKDM4AKDM4CADA
SCHEMBL31333075 0.78 MAPT (0.45) KDM5BKDM5AKDM4AKDM4CMAOB
SCHEMBL2968205 0.77 ALDH1A1 (0.51) KDM5BKDM5AKDM4AKDM4CALDH1A1

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-0248414-B1 ARALKYL IMIDAZOLE DERIVATIVES CIBA-GEIGY AG (CH) 1992-09-23 EP claimed
US-4851424-A 1-Phenyl-lower alkyl-imidazole 4- or 5-carboxamide compounds which are useful in the treatment of epilepsy CIBA-GEIGY CORPORATION (US) 1989-07-25 US claimed
EP-0248414-A2 Aralkyl imidazole derivatives CIBA-GEIGY AG (CH) 1987-12-09 EP claimed
EP-0248414-B1 ARALKYL IMIDAZOLE DERIVATIVES CIBA-GEIGY AG (CH) 1992-09-23 EP disclosed
US-4851424-A 1-Phenyl-lower alkyl-imidazole 4- or 5-carboxamide compounds which are useful in the treatment of epilepsy CIBA-GEIGY CORPORATION (US) 1989-07-25 US disclosed
EP-0248414-A2 Aralkyl imidazole derivatives CIBA-GEIGY AG (CH) 1987-12-09 EP disclosed