SCHEMBL20978718

SCHEMBL20978718

CN(CCN1C=C(c2cc(C(=O)O)ccn2)NC1)c1ccc(Cl)cc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 13/20 0.63
▸ KDM4A O75164 3/20 0.63
▸ KDM5B Q9UGL1 4/20 0.45
▸ KDM5A P29375 3/20 0.45
▸ JMJD6 Q6NYC1 1/20 0.41
▸ KDM2B Q8NHM5 3/20 0.41
▸ KDM5C P41229 1/20 0.37
▸ KMO O15229 1/20 0.37

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
SCHEMBL20978805 0.86 KDM5B (0.59) KDM4CKDM4AKDM5BKDM5AJMJD6
SCHEMBL20978862 0.81 KDM4C (0.68) KDM4CKDM4AKDM5BKDM5AKDM2B
SCHEMBL20978783 0.79 KDM2B (0.64) KDM4CKDM4AKDM5BKDM5AJMJD6
SCHEMBL20978804 0.79 KDM2B (0.63) KDM4CKDM4AKDM5BKDM5AJMJD6
SCHEMBL16033374 0.78 KDM4C (1.00) KDM4CKDM4AKDM5BKDM5AKDM2B
SCHEMBL20978815 0.75 KDM4C (0.48) KDM4CKDM4AKDM5BKDM5AKDM2B
SCHEMBL20978720 0.73 KDM4C (0.69) KDM4CKDM4AKDM5BKDM5AKDM2B
SCHEMBL20979006 0.73 JMJD6 (0.54) KDM4CKDM4AKDM5BKDM5AJMJD6
SCHEMBL20978807 0.73 KDM5B (0.62) KDM4CKDM4AKDM5BKDM5AJMJD6
SCHEMBL20978859 0.72 KDM2B (0.44) KDM4CKDM4AKDM5BKDM5AJMJD6

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
EP-2969007-B1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2019-05-08 — — EP disclosed
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