SCHEMBL8920587

SCHEMBL8920587

CCOC(=O)/C=C/c1ccc2c(c1)c1cc(/C=C/C(=O)OCC)ccc1n2CC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.59
DPP4 P27487 1/20 0.59
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 0.56
CA14 Q9ULX7 1/20 0.56
MAOB P27338 1/20 0.54
CYP3A4 P08684 1/20 0.53
NPC1 O15118 1/20 0.53
CASP3 P42574 1/20 0.53
RAB9A P51151 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
FDPS P14324 1/20 0.52
PTGER4 P35408 2/20 0.49
ALOX5 P09917 1/20 0.47
SRC P12931 2/20 0.47

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
SCHEMBL8920599 1.00 TTR (0.59) TTRDPP4CA12CA1CA2
SCHEMBL8921066 0.82 KDM4E (0.53) TTRDPP4CA12CA1CA2
SCHEMBL8921074 0.82 KDM4E (0.53) TTRDPP4CA12CA1CA2
SCHEMBL10939791 0.78 CA12 (0.86) TTRDPP4CA12CA1CA2
SCHEMBL5059085 0.78 CA12 (0.86) TTRDPP4CA12CA1CA2
SCHEMBL13957401 0.78 CA12 (0.86) TTRDPP4CA12CA1CA2
SCHEMBL12244182 0.78 KDM4E (0.63) SRCKDM4EPOLBPKMHTT
SCHEMBL29641676 0.78 KDM4E (0.63) SRCKDM4EPOLBPKMHTT
SCHEMBL11217092 0.77 TTR (0.71) TTRDPP4CA12CA1CA2
SCHEMBL11217091 0.77 TTR (0.71) TTRDPP4CA12CA1CA2

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
US-5670493-A ANGIOGENESIS INHIBITORS ADIR ET COMPAGNIE (FR) 1997-09-23 US disclosed