SCHEMBL19101701

SCHEMBL19101701

OC(O)c1ccnc(-c2cn(CCN3Cc4ccc(F)cc4C3)cn2)c1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 10/20 0.47
▸ KDM2B Q8NHM5 6/20 0.47
▸ KDM4A O75164 4/20 0.47
▸ KDM5A P29375 9/20 0.42
▸ KDM5B Q9UGL1 9/20 0.42
▸ KDM6B O15054 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
SCHEMBL19139044 0.88 KDM2B (0.47) KDM4CKDM2BKDM4AKDM5AKDM5B
SCHEMBL19101674 0.87 KDM4C (0.46) KDM4CKDM2BKDM4AKDM5AKDM5B
SCHEMBL19102093 0.87 KDM2B (0.41) KDM4CKDM2BKDM4AKDM5AKDM5B
SCHEMBL16033033 0.82 KDM4C (0.69) KDM4CKDM2BKDM4AKDM5AKDM5B
SCHEMBL19101734 0.78 KDM2B (0.41) KDM4CKDM2BKDM4AKDM5AKDM5B
SCHEMBL19101682 0.78 KDM5B (0.66) KDM4CKDM2BKDM4AKDM5AKDM5B
SCHEMBL19101737 0.77 KDM2B (0.40) KDM4CKDM2BKDM4AKDM5AKDM5B
SCHEMBL19101706 0.71 KDM5A (0.67) KDM4CKDM2BKDM4AKDM5AKDM5B
SCHEMBL18612739 0.70 KDM4C (0.71) KDM4CKDM2BKDM4AKDM5AKDM5B
SCHEMBL16034727 0.69 KDM4C (0.68) KDM4CKDM2BKDM4AKDM5AKDM5B

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
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