SCHEMBL71224

SCHEMBL71224

COC(=O)/C=C/c1ccc(/C=C/C(=O)OC)cc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.84
CA1 P00915 3/20 0.84
CA2 P00918 3/20 0.84
CA7 P43166 3/20 0.84
CA9 Q16790 3/20 0.84
CA14 Q9ULX7 3/20 0.84
TYR P14679 1/20 0.84
PTPN1 P18031 1/20 0.70
TTR P02766 1/20 0.69
APP P05067 1/20 0.69
EPHX2 P34913 1/20 0.62
MAPT P10636 5/20 0.61
KDM4E B2RXH2 4/20 0.61
ALDH1A1 P00352 4/20 0.61
JAK2 O60674 1/20 0.61
GAA P10253 1/20 0.61
HTT P42858 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
FDPS P14324 1/20 0.57
GSK3B P49841 1/20 0.57

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
SCHEMBL5057418 1.00 CA12 (0.84) CA12CA1CA2CA7CA9
SCHEMBL504081 0.92 CA12 (0.72) CA12CA1CA2CA7CA9
Methyl P-Hydroxycinnamate SCHEMBL28386655 0.92 CA12 (1.00) CA12CA1CA2CA7CA9
Methyl P-Hydroxycinnamate SCHEMBL895938 0.92 CA12 (1.00) CA12CA1CA2CA7CA9
SCHEMBL2472987 0.92 CA12 (0.72) CA12CA1CA2CA7CA9
SCHEMBL19397275 0.92 CA12 (0.72) CA12CA1CA2CA7CA9
Methyl P-Hydroxycinnamate SCHEMBL547438 0.92 CA12 (1.00) CA12CA1CA2CA7CA9
Methyl P-Hydroxycinnamate SCHEMBL30463538 0.92 CA12 (1.00) CA12CA1CA2CA7CA9
SCHEMBL20653 0.92 CA12 (0.72) CA12CA1CA2CA7CA9
SCHEMBL20654 0.92 CA12 (0.72) CA12CA1CA2CA7CA9

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2479203-A1 AROMATIC POLYESTER Muroran Institute of Technology (JP) 2012-07-25 EP disclosed
US-20120172570-A1 AROMATIC POLYESTER NITTA CORPORATION 2012-07-05 US disclosed
US-8129493-B2 Aromatic polyester MURORAN INSTITUTE OF TECHNOLOGY (JP) 2012-03-06 US disclosed
US-20110092662-A1 AROMATIC POLYESTER NITTA CORPORATION (JP) 2011-04-21 US disclosed
US-5670493-A ANGIOGENESIS INHIBITORS ADIR ET COMPAGNIE (FR) 1997-09-23 US disclosed