SCHEMBL9714289

SCHEMBL9714289

NC(=O)c1cn(Cc2cccc(F)c2F)cn1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA5A P35218 1/20 0.45
KDM5A P29375 2/20 0.44
KDM5B Q9UGL1 2/20 0.44
KDM4A O75164 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
AURKA O14965 1/20 0.42
PDPK1 O15530 1/20 0.42
RPS6KB1 P23443 1/20 0.42
ADA P00813 6/20 0.39
GRM2 Q14416 5/20 0.38
MET P08581 1/20 0.37
ALKBH1 Q13686 1/20 0.37
MAOB P27338 1/20 0.35
PARP15 Q460N3 1/20 0.35
PARP14 Q460N5 1/20 0.35
PARP10 Q53GL7 1/20 0.35
STAT6 P42226 1/20 0.35

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
SCHEMBL9714348 0.89 KDM5B (0.54) CA5AKDM5AKDM5BKDM4AKDM4C
SCHEMBL9714146 0.85 CA5A (0.58) CA5AKDM5AKDM5BKDM4AKDM4C
SCHEMBL10567701 0.81 CYP1A2 (0.43) KDM5AKDM5BKDM4AKDM4C
SCHEMBL9714457 0.78 GRM2 (0.43) CA5AKDM5AKDM5BKDM4AKDM4C
SCHEMBL9714527 0.78 GRM2 (0.43) KDM5AKDM5BKDM4AKDM4CAURKA
SCHEMBL9714504 0.78 CYP11B1 (0.47) KDM5AKDM5BKDM4AKDM4CAURKA
SCHEMBL9714098 0.78 LMNA (0.50) KDM5AKDM5BKDM4CADA
SCHEMBL9857834 0.76 CA5A (0.73) CA5AAURKAPDPK1RPS6KB1GRM2
SCHEMBL15965384 0.76 KDM4C (0.57) KDM4CAURKARPS6KB1ADAGRM2
SCHEMBL9714533 0.74 GRM2 (0.48) KDM5AKDM5BKDM4AKDM4CAURKA

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 3 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 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