SCHEMBL20125439

SCHEMBL20125439

O=Cc1ccnc2cc(C(=O)N3CCCC(c4ccccc4)C3)[nH]c12

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 4/20 0.75
KDM5A P29375 2/20 0.75
KDM5B Q9UGL1 2/20 0.75
PROKR1 Q8TCW9 7/20 0.51
ALDH1A1 P00352 3/20 0.47
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 1/20 0.43
HIF1A Q16665 1/20 0.43

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
SCHEMBL16151100 0.86 KDM4C (1.00) KDM4CKDM5AKDM5BPROKR1ALDH1A1
SCHEMBL20125366 0.85 KDM4C (0.77) KDM4CKDM5AKDM5BPROKR1ALDH1A1
SCHEMBL20125334 0.83 KDM4C (0.66) KDM4CKDM5AKDM5BALDH1A1TP53
SCHEMBL16149743 0.82 KDM4C (0.81) KDM4CKDM5AKDM5BPROKR1ALDH1A1
SCHEMBL20125368 0.82 KDM4C (0.68) KDM4CKDM5AKDM5BALDH1A1TP53
SCHEMBL16149299 0.81 KDM4C (1.00) KDM4CKDM5AKDM5BPROKR1
SCHEMBL20125440 0.78 KDM4C (0.72) KDM4CKDM5AKDM5BPROKR1ALDH1A1
SCHEMBL16150318 0.77 KDM4C (0.80) KDM4CKDM5AKDM5BPROKR1
SCHEMBL20125377 0.72 KDM4C (0.73) KDM4CKDM5AKDM5BALDH1A1MAPT
SCHEMBL20125271 0.70 KDM4C (0.72) KDM4CKDM5AKDM5B

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