SCHEMBL19101673

SCHEMBL19101673

Cn1cnc(-c2cc(C(O)O)ccn2)c1-c1ccc(F)cc1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 15/20 0.65
KDM5A P29375 8/20 0.65
KDM5B Q9UGL1 8/20 0.65
KDM4A O75164 1/20 0.65
PHF8 Q9UPP1 2/20 0.58
MAPK14 Q16539 1/20 0.54
KDM2B Q8NHM5 9/20 0.54
NR3C2 P08235 2/20 0.50

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
SCHEMBL18612762 0.85 KDM4C (0.69) KDM4CKDM5AKDM5BKDM4APHF8
SCHEMBL18613077 0.84 KDM4C (0.67) KDM4CKDM5AKDM5BKDM4APHF8
SCHEMBL18612761 0.83 KDM4C (0.67) KDM4CKDM5AKDM5BKDM4AKDM2B
SCHEMBL19101738 0.81 KDM4C (0.71) KDM4CKDM5AKDM5BKDM4APHF8
SCHEMBL18612871 0.80 KDM4C (0.70) KDM4CKDM5AKDM5BKDM4AKDM2B
SCHEMBL16033660 0.79 KDM4C (1.00) KDM4CKDM5AKDM5BKDM4AKDM2B
SCHEMBL18612738 0.78 KDM4C (0.70) KDM4CKDM5AKDM5BKDM4APHF8
SCHEMBL18612884 0.78 KDM4C (0.70) KDM4CKDM5AKDM5BKDM4APHF8
SCHEMBL19634840 0.78 KDM4C (0.69) KDM4CKDM5AKDM5BKDM4AKDM2B
SCHEMBL22756753 0.78 NPC1 (0.44) KDM4CKDM5AKDM5BKDM2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9701657-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2017-07-11 US disclosed