SCHEMBL11289265

SCHEMBL11289265

Oc1cc(C=Cc2ccccc2)c(O)c(C=Cc2ccccc2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.60
TRPA1 O75762 1/20 0.57
TTR P02766 1/20 0.53
ALOX5 P09917 1/20 0.53
PTGS1 P23219 1/20 0.53
PTGS2 P35354 1/20 0.53
KDM4E B2RXH2 2/20 0.52
MEN1 O00255 2/20 0.52
USP2 O75604 2/20 0.52
ALDH1A1 P00352 2/20 0.52
TP53 P04637 2/20 0.52
CYP3A4 P08684 2/20 0.52
MAPT P10636 2/20 0.52
HPGD P15428 2/20 0.52
KMT2A Q03164 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
HSD17B10 Q99714 2/20 0.52
TRPV1 Q8NER1 1/20 0.52
PELI1 Q96FA3 1/20 0.47
NFE2L2 Q16236 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
SCHEMBL27677458 0.90 PTPN1 (0.76) PTPN1TRPA1TTRALOX5PTGS1
SCHEMBL1982134 0.89 TTR (0.61) PTPN1TRPA1TTRALOX5PTGS1
SCHEMBL3681557 0.89 TTR (0.61) PTPN1TRPA1TTRALOX5PTGS1
SCHEMBL1500568 0.83 PTGS1 (0.60) TRPA1TTRALOX5PTGS1PTGS2
SCHEMBL1500567 0.83 PTGS1 (0.60) TRPA1TTRALOX5PTGS1PTGS2
SCHEMBL15797144 0.82 TRPA1 (0.68) TRPA1TTRALOX5PTGS1PTGS2
SCHEMBL15797145 0.82 TRPA1 (0.68) TRPA1TTRALOX5PTGS1PTGS2
Pinosylvin SCHEMBL9419839 0.79 LCK (0.71) TRPA1TTRALOX5PTGS1PTGS2
Pinosylvin SCHEMBL2237657 0.79 LCK (0.71) TRPA1TTRALOX5PTGS1PTGS2
Pinosylvin SCHEMBL20455852 0.79 LCK (0.71) TRPA1TTRALOX5PTGS1PTGS2

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
EP-0048878-A1 Phosphorous-acid esters containing hydroxyphenyl groups, process for their preparation and their use as stabilisers for thermoplastic polyesters BAYER AG (DE) 1982-04-07 EP disclosed