SCHEMBL13619571

SCHEMBL13619571

Cc1ccn2nncc2n1

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 2/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
ATM Q13315 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CCR1 P32246 1/20 0.30
CCR5 P51681 1/20 0.30
SMPD3 Q9NY59 1/20 0.30

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
SCHEMBL12604058 0.75 KDM4E (0.33) KDM4E
SCHEMBL12650343 0.75
SCHEMBL545249 0.68 KDM4E (0.50) KDM4EALDH1A1RAB9ANPC1MAPT
SCHEMBL2750457 0.68 TGFBR1 (0.51) KDM4EALDH1A1RAB9ANPC1MAPT
SCHEMBL4151566 0.65 HTR6 (0.31) KDM4EALDH1A1
SCHEMBL16478033 0.64 PIK3CG (0.50) KDM4EALDH1A1RAB9ANPC1MAPT
SCHEMBL3132802 0.64 KDM4E (0.39) KDM4EALDH1A1RAB9ANPC1MAPT
SCHEMBL12761243 0.64 HSD17B10 (0.39) KDM4EALDH1A1RAB9ANPC1MAPT
SCHEMBL21097673 0.63 KDM4E (0.36) KDM4EALDH1A1RAB9ANPC1MAPT
SCHEMBL20048908 0.63 CSNK1A1 (0.45) KDM4EALDH1A1RAB9ANPC1MAPT

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
WO-2009143477-A1 HETEROCYCLES AS PROTEIN KINASE INHIBITORS AMGEN INC. (US) 2009-11-26 WO disclosed