SCHEMBL15635925

SCHEMBL15635925

O=C(O)c1ccnc(CNCC[C@@]2(Cc3ccccc3)CCCN2)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 14/20 0.45
▸ KDM5C P41229 7/20 0.45
▸ KDM4A O75164 6/20 0.45
▸ KDM4B O94953 2/20 0.45
▸ KDM4C Q9H3R0 7/20 0.39
▸ KDM5A P29375 8/20 0.38
▸ KDM2B Q8NHM5 2/20 0.38
▸ KDM6B O15054 2/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ SCN9A Q15858 1/20 0.35
▸ SCN8A Q9UQD0 1/20 0.35
▸ SLC6A2 P23975 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ KDM2A Q9Y2K7 1/20 0.33
▸ KDM3A Q9Y4C1 1/20 0.33

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
SCHEMBL16297326 0.80 KDM5B (0.43) KDM5BKDM5CKDM4AKDM4BKDM4C
SCHEMBL16291866 0.69 KDM5B (0.44) KDM5BKDM5CKDM4AKDM4BKDM4C
SCHEMBL23120658 0.68 KDM5B (0.52) KDM5BKDM5CKDM4AKDM4BKDM4C
SCHEMBL15637115 0.68 KDM5B (0.52) KDM5BKDM5CKDM4AKDM4BKDM4C
SCHEMBL15637050 0.67 KDM5B (0.42) KDM5BKDM5CKDM4AKDM4BKDM4C
SCHEMBL17144427 0.67 KDM5B (0.47) KDM5BKDM5CKDM4AKDM4BKDM4C
SCHEMBL15635924 0.67 KDM5B (0.45) KDM5BKDM5CKDM4AKDM4BKDM4C
SCHEMBL15635926 0.67 KDM5B (0.45) KDM5BKDM5CKDM4AKDM4BKDM4C
SCHEMBL17772490 0.66 KDM5B (0.50) KDM5BKDM5CKDM4AKDM4BKDM4C
SCHEMBL17144500 0.66 KDM5B (0.61) KDM5BKDM5CKDM4AKDM4BKDM4C

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2903968-A1 INHIBITORS OF HISTONE DEMETHYLASES Epitherapeutics ApS (DK) 2015-08-12 — — EP disclosed
WO-2014053491-A1 INHIBITORS OF HISTONE DEMETHYLASES EPITHERAPEUTICS APS (DK) 2014-04-10 — — WO disclosed
Send feedback