SCHEMBL13587155

SCHEMBL13587155

COc1cc2nccc(Oc3ccc4nc(NC(=O)c5ccc(C)s5)sc4c3)c2cc1OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 5/20 0.67
KDR P35968 13/20 0.54
NPC1 O15118 5/20 0.54
RAB9A P51151 5/20 0.54
ALDH1A1 P00352 3/20 0.54
TP53 P04637 3/20 0.54
KDM4E B2RXH2 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
MEN1 O00255 2/20 0.54
HPGD P15428 2/20 0.54
KMT2A Q03164 2/20 0.54
HSD17B10 Q99714 2/20 0.54
POLB P06746 1/20 0.54
MAPT P10636 1/20 0.54
CASP1 P29466 1/20 0.54
CASP7 P55210 1/20 0.54
AXL P30530 1/20 0.53
TSHR P16473 1/20 0.52
AURKA O14965 4/20 0.51

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
SCHEMBL13587167 0.90 MET (0.66) METKDRNPC1RAB9AALDH1A1
SCHEMBL13587154 0.90 NPC1 (0.68) METKDRNPC1RAB9AALDH1A1
SCHEMBL13587159 0.89 MET (0.64) METKDRNPC1RAB9AALDH1A1
SCHEMBL13587152 0.88 MET (0.63) METKDRNPC1RAB9AALDH1A1
SCHEMBL13587174 0.87 AXL (0.71) METKDRNPC1RAB9AALDH1A1
SCHEMBL4378894 0.87 MET (0.68) METKDRNPC1RAB9AALDH1A1
SCHEMBL4379209 0.86 MET (0.70) METKDRNPC1RAB9AALDH1A1
SCHEMBL13587165 0.86 MET (0.67) METKDRNPC1RAB9AALDH1A1
SCHEMBL4368604 0.86 MET (0.77) METKDRNPC1RAB9ATP53
SCHEMBL4367742 0.85 MET (0.71) METKDRNPC1RAB9AKDM4E

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