SCHEMBL13587164

SCHEMBL13587164

COc1cc2nccc(Oc3ccc4nc(NC(=O)c5csc(C)n5)sc4c3)c2cc1OC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.65
AXL P30530 3/20 0.54
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
MAPT P10636 2/20 0.53
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
USP2 O75604 1/20 0.53
TP53 P04637 1/20 0.53
POLB P06746 1/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
KDR P35968 11/20 0.53
MAPK1 P28482 1/20 0.52
PDGFRA P16234 3/20 0.49
PKM P14618 1/20 0.49
OPRK1 P41145 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
AURKA O14965 2/20 0.48
LCK P06239 2/20 0.48

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
SCHEMBL13587150 0.87 NPC1 (0.72) METAXLNPC1RAB9AMAPT
SCHEMBL13587149 0.86 MET (0.65) METAXLNPC1RAB9AMAPT
SCHEMBL13587161 0.86 MET (0.65) METAXLNPC1RAB9AMAPT
SCHEMBL13587165 0.86 MET (0.67) METAXLNPC1RAB9AMAPT
SCHEMBL4378894 0.85 MET (0.68) METAXLNPC1RAB9AKMT2A
SCHEMBL4379209 0.85 MET (0.70) METAXLNPC1RAB9AKMT2A
SCHEMBL13587168 0.85 MET (0.65) METAXLNPC1RAB9AMAPT
SCHEMBL4372566 0.84 MET (0.67) METAXLNPC1RAB9AKMT2A
SCHEMBL13587155 0.84 MET (0.67) METAXLNPC1RAB9AMAPT
SCHEMBL13587143 0.84 MET (0.67) METAXLNPC1RAB9AMAPT

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
US-7626030-B2 Compounds and methods of use AMGEN INC. (US) 2009-12-01 US disclosed
US-7626030-B2 Compounds and methods of use AMGEN INC. (US) 2009-12-01 US disclosed