SCHEMBL20125306

SCHEMBL20125306

O=C(O)c1ccnc2cc(C(=O)N3CCC4=C3C=CCC4)[nH]c12

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 11/20 0.62
KDM5A P29375 16/20 0.58
KDM5B Q9UGL1 15/20 0.58
KDM4A O75164 2/20 0.42

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
SCHEMBL20125308 0.88 KDM4C (0.48) KDM4CKDM5AKDM5B
SCHEMBL16150489 0.77 KDM4C (1.00) KDM4CKDM5AKDM5BKDM4A
SCHEMBL16157351 0.75 KDM5A (0.97) KDM4CKDM5AKDM5BKDM4A
SCHEMBL16148830 0.74 KDM5A (1.00) KDM4CKDM5AKDM5BKDM4A
SCHEMBL16149889 0.73 KDM4C (1.00) KDM4CKDM5AKDM5BKDM4A
SCHEMBL16157398 0.70 KDM5A (0.74) KDM4CKDM5AKDM5BKDM4A
SCHEMBL16149899 0.70 KDM4C (1.00) KDM4CKDM5AKDM5BKDM4A
SCHEMBL20125329 0.69 KDM4C (0.71) KDM4CKDM5AKDM5BKDM4A
SCHEMBL16148987 0.69 KDM5A (1.00) KDM4CKDM5AKDM5BKDM4A
SCHEMBL16149299 0.67 KDM4C (1.00) KDM4CKDM5AKDM5BKDM4A

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-2968282-B1 HISTONE DEMENTHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2018-05-09 EP disclosed