SCHEMBL20125458

SCHEMBL20125458

O=C(O)c1ccnc2cc([C@@H](O)C3CC3)[nH]c12

nearest known ligand 0.84

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 10/20 0.84
KDM4A O75164 3/20 0.84
KDM5B Q9UGL1 14/20 0.67
KDM5A P29375 13/20 0.67

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
SCHEMBL16150767 1.00 KDM4C (0.84) KDM4CKDM4AKDM5BKDM5A
SCHEMBL16149653 0.92 KDM4C (1.00) KDM4CKDM4AKDM5BKDM5A
SCHEMBL16149383 0.85 KDM4C (0.64) KDM4CKDM4AKDM5BKDM5A
SCHEMBL16150732 0.84 KDM5B (0.70) KDM4CKDM4AKDM5BKDM5A
SCHEMBL16150864 0.81 KDM5A (1.00) KDM4CKDM4AKDM5BKDM5A
SCHEMBL16149493 0.80 KDM5B (1.00) KDM4CKDM4AKDM5BKDM5A
SCHEMBL16157326 0.80 KDM5A (1.00) KDM4CKDM4AKDM5BKDM5A
SCHEMBL17899546 0.78 KDM5B (0.59) KDM4CKDM4AKDM5BKDM5A
SCHEMBL17899513 0.78 KDM5B (0.59) KDM4CKDM4AKDM5BKDM5A
SCHEMBL16150955 0.78 KDM4C (0.77) KDM4CKDM4AKDM5BKDM5A

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