SCHEMBL20125475

SCHEMBL20125475

CON=Cc1ccnc2cc(C(O)c3ccccc3)[nH]c12

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 12/20 0.56
KDM4C Q9H3R0 8/20 0.50
KDM4A O75164 3/20 0.50
KDM5B Q9UGL1 7/20 0.39
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL20125370 0.89 KDM5A (0.62) KDM5AKDM4CKDM4AKDM5B
SCHEMBL20125340 0.88 KDM4C (0.64) KDM5AKDM4CKDM4AKDM5BKDM4E
SCHEMBL20125349 0.85 KDM4C (0.58) KDM5AKDM4CKDM4AKDM5BKDM4E
SCHEMBL20125360 0.78 KDM4C (0.65) KDM5AKDM4CKDM4AKDM5BKDM4E
SCHEMBL16150996 0.74 KDM5A (0.80) KDM5AKDM4CKDM4AKDM5B
SCHEMBL20125476 0.73 KDM4C (0.70) KDM5AKDM4CKDM4AKDM5BKDM4E
SCHEMBL16149673 0.72 KDM5A (1.00) KDM5AKDM4CKDM4AKDM5B
SCHEMBL20125332 0.70 KDM4C (0.62) KDM5AKDM4CKDM4AKDM5BKDM4E
SCHEMBL12757021 0.69 MEN1 (0.49) KDM4EMAPK1NPSR1
SCHEMBL16149068 0.67 KDM4C (1.00) 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