SCHEMBL9744878

SCHEMBL9744878

Oc1cc(O)c(/C=C/c2ccccc2)c(O)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 2/20 0.59
▸ SLC5A1 P13866 1/20 0.55
▸ SLC5A2 P31639 1/20 0.55
▸ TRPA1 O75762 1/20 0.52
▸ KDM4E B2RXH2 3/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ CYP3A4 P08684 3/20 0.52
▸ MAPT P10636 3/20 0.52
▸ HPGD P15428 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ HSD17B10 Q99714 3/20 0.52
▸ USP2 O75604 2/20 0.52
▸ TP53 P04637 2/20 0.52
▸ TRPV1 Q8NER1 1/20 0.52
▸ AHR P35869 1/20 0.48
▸ ALOX5 P09917 1/20 0.48
▸ PTGS1 P23219 1/20 0.48
▸ PTGS2 P35354 1/20 0.48

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
SCHEMBL9744884 1.00 TTR (0.59) TTRSLC5A1SLC5A2TRPA1KDM4E
SCHEMBL29390529 0.84 TRPA1 (0.54) TTRSLC5A1SLC5A2TRPA1KDM4E
SCHEMBL1425963 0.82 TTR (0.63) TTRTRPA1MAPTAHRALOX5
SCHEMBL1425965 0.82 TTR (0.63) TTRTRPA1MAPTAHRALOX5
SCHEMBL1822107 0.81 TTR (0.52) TTRTRPA1KDM4EMEN1ALDH1A1
SCHEMBL1822108 0.81 TTR (0.52) TTRTRPA1KDM4EMEN1ALDH1A1
SCHEMBL28655289 0.80 TRPA1 (0.50) TTRSLC5A1SLC5A2TRPA1KDM4E
Pinosylvin SCHEMBL20455852 0.79 LCK (0.71) TTRTRPA1KDM4EMEN1ALDH1A1
Pinosylvin SCHEMBL454262 0.79 LCK (0.71) TTRTRPA1KDM4EMEN1ALDH1A1
Pinosylvin SCHEMBL3940383 0.79 LCK (0.71) TTRTRPA1KDM4EMEN1ALDH1A1

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-5087548-A POSITIVE TYPE RADIATION-SENSITIVE RESIN COMPOSITION JAPAN SYNTHETIC RUBBER CO., INC. (JP) 1992-02-11 — — US disclosed
EP-0227487-A2 Positive type radiation-sensitive resin composition JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1987-07-01 — — EP disclosed
Send feedback