SCHEMBL20125307

SCHEMBL20125307

CCCOC(c1cc2nccc(C=O)c2[nH]1)c1ccccc1Cl

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 15/20 0.71
KDM4C Q9H3R0 6/20 0.71
KDM4A O75164 3/20 0.34
KDM5B Q9UGL1 4/20 0.34
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL16157407 0.83 KDM5A (1.00) KDM5AKDM4CKDM4AKDM5B
SCHEMBL16157350 0.82 KDM5A (0.82) KDM5AKDM4CKDM4AKDM5B
SCHEMBL20125300 0.70 KDM5B (0.64) KDM5AKDM4CKDM4AKDM5B
SCHEMBL20125322 0.68 KDM5A (0.62) KDM5AKDM4CKDM4AKDM5B
SCHEMBL20125349 0.67 KDM4C (0.58) KDM5AKDM4CKDM4AKDM5BALDH1A1
SCHEMBL20125343 0.67 KDM4C (0.49) KDM5AKDM4CKDM4AKDM5B
SCHEMBL20125332 0.66 KDM4C (0.62) KDM5AKDM4CKDM4AKDM5BALDH1A1
SCHEMBL20125476 0.65 KDM4C (0.70) KDM5AKDM4CKDM4AKDM5B
SCHEMBL20125299 0.63 KDM4E (0.36) KDM5AKDM4CKDM4AKDM5B
SCHEMBL16149482 0.63 KDM4C (0.76) KDM5AKDM4CKDM4AKDM5B

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