SCHEMBL775118

SCHEMBL775118

O=C(N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SSTR3 P32745 6/20 0.61
NPC1 O15118 3/20 0.57
RAB9A P51151 3/20 0.57
MMP2 P08253 1/20 0.55
MMP7 P09237 1/20 0.55
MMP9 P14780 1/20 0.55
MMP13 P45452 1/20 0.55
ALDH1A1 P00352 2/20 0.54
TSHR P16473 1/20 0.54
HSD17B10 Q99714 1/20 0.54
F10 P00742 1/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HTT P42858 1/20 0.53

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
SCHEMBL774564 0.96 MMP2 (0.59) SSTR3NPC1RAB9AMMP2MMP7
SCHEMBL106877 0.92 NPC1 (0.56) SSTR3NPC1RAB9AALDH1A1HSD17B10
SCHEMBL1727942 0.89 SSTR3 (0.52) SSTR3NPC1RAB9AMMP2MMP7
SCHEMBL7348189 0.89 NPSR1 (0.58) SSTR3NPC1RAB9AMMP2MMP7
SCHEMBL7348191 0.89 NPSR1 (0.58) SSTR3NPC1RAB9AMMP2MMP7
SCHEMBL7348185 0.89 NPSR1 (0.58) SSTR3NPC1RAB9AMMP2MMP7
SCHEMBL5032040 0.89 SSTR3 (0.52) SSTR3NPC1RAB9AMMP2MMP7
SCHEMBL8803719 0.89 SSTR3 (0.52) SSTR3NPC1RAB9AMMP2MMP7
SCHEMBL1756678 0.89 SSTR3 (0.52) SSTR3NPC1RAB9AMMP2MMP7
SCHEMBL603555 0.89 SSTR3 (0.52) SSTR3NPC1RAB9AMMP2MMP7

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-8673998-B2 Polymer compositions with improved cold flow BRIDGESTONE CORPORATION (JP) 2014-03-18 US disclosed
US-20120071583-A1 POLYMER COMPOSITIONS WITH IMPROVED COLD FLOW BRIDGESTONE CORPORATION (JP) 2012-03-22 US disclosed