SCHEMBL13587147

SCHEMBL13587147

COc1cc2nccc(Oc3ccc4nc(NC(=O)c5sccc5Br)sc4c3)c2cc1OC

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.64
KDR P35968 7/20 0.56
AXL P30530 3/20 0.51
PDGFRA P16234 3/20 0.50
NPC1 O15118 7/20 0.49
RAB9A P51151 7/20 0.49
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
KDM4E B2RXH2 3/20 0.49
MAPT P10636 3/20 0.49
TP53 P04637 2/20 0.49
POLB P06746 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HSD17B10 Q99714 1/20 0.49
SCD O00767 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
SCHEMBL13587168 0.91 MET (0.65) METKDRAXLPDGFRANPC1
SCHEMBL13587151 0.90 MET (0.64) METKDRAXLPDGFRANPC1
SCHEMBL13587153 0.89 MET (0.64) METKDRAXLPDGFRANPC1
SCHEMBL4379209 0.86 MET (0.70) METKDRAXLPDGFRANPC1
SCHEMBL13587165 0.85 MET (0.67) METKDRAXLPDGFRANPC1
SCHEMBL13587148 0.85 MET (0.62) METKDRAXLNPC1RAB9A
SCHEMBL13587174 0.85 AXL (0.71) METKDRAXLPDGFRANPC1
SCHEMBL13587154 0.85 NPC1 (0.68) METKDRAXLPDGFRANPC1
SCHEMBL4378894 0.84 MET (0.68) METKDRAXLPDGFRANPC1
SCHEMBL4368604 0.84 MET (0.77) METKDRPDGFRANPC1RAB9A

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