SCHEMBL19676424

SCHEMBL19676424

COCCN1CCCN(C(=O)CNCc2cc(C(=O)O)ccn2)CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 6/20 0.43
▸ KDM5C P41229 3/20 0.43
▸ KDM4A O75164 2/20 0.43
▸ KDM5A P29375 2/20 0.43
▸ KDM2B Q8NHM5 2/20 0.43
▸ KDM6B O15054 1/20 0.43
▸ KDM1A O60341 7/20 0.42
▸ KDM4C Q9H3R0 2/20 0.40
▸ DRD3 P35462 2/20 0.39
▸ PDE3B Q13370 1/20 0.38
▸ PDE3A Q14432 1/20 0.38
▸ NAMPT P43490 1/20 0.38

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
SCHEMBL15636702 0.96 KDM5B (0.46) KDM5BKDM5CKDM4AKDM5AKDM2B
SCHEMBL15636442 0.84 KDM5B (0.52) KDM5BKDM5CKDM4AKDM5AKDM2B
SCHEMBL19664330 0.82 KDM1A (0.42) KDM1ADRD3PDE3BPDE3A
SCHEMBL16291811 0.73 KDM5C (0.51) KDM5BKDM5CKDM4AKDM5AKDM2B
SCHEMBL15637693 0.73 KDM2B (0.51) KDM5BKDM5CKDM4AKDM5AKDM2B
SCHEMBL15636980 0.73 KDM5B (0.59) KDM5BKDM5CKDM4AKDM5AKDM2B
SCHEMBL19676471 0.72 KDM2B (0.42) KDM5BKDM5CKDM4AKDM5AKDM2B
SCHEMBL17144250 0.72 CYP2D6 (0.46) KDM5BKDM5CKDM4AKDM5AKDM2B
SCHEMBL15636566 0.71 KDM2B (0.49) KDM5BKDM5CKDM4AKDM5AKDM2B
SCHEMBL21257720 0.71 KDM4C (0.50) KDM5BKDM5CKDM5AKDM2BKDM6B

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-3023415-B1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES INC (US) 2017-12-06 — — EP disclosed
Send feedback