SCHEMBL10698192

SCHEMBL10698192

C=C(C)C(OOCCCCCC)OC(=O)OC(OOCCCCCC)C(=C)C

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
CES2 O00748 3/20 0.40
PLA2G2C Q5R387 5/20 0.38
NAAA Q02083 1/20 0.37
LMNA P02545 2/20 0.35
EPHX1 P07099 1/20 0.35
LPAR1 Q92633 2/20 0.33
LPAR3 Q9UBY5 2/20 0.33
LPAR2 Q9HBW0 1/20 0.33

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
SCHEMBL10698317 0.93 ALDH1A1 (0.38) TSHRCES2PLA2G2CLMNA
SCHEMBL10698196 0.89 TSHR (0.44) TSHRCES2PLA2G2CNAAALMNA
SCHEMBL10456590 0.74 PLA2G2C (0.39) TSHRCES2PLA2G2CNAAALMNA
SCHEMBL10763354 0.72 TSHR (0.46) TSHRNAAALMNAEPHX1
SCHEMBL11231305 0.70 SMPD1 (0.43) LMNA
SCHEMBL11224048 0.70 SMPD1 (0.43) LMNA
SCHEMBL22117323 0.69 NAAA (0.46) TSHRNAAALMNAEPHX1
SCHEMBL9852414 0.68 HCAR2 (0.46) TSHRCES2NAAAEPHX1
SCHEMBL15284836 0.67 TSHR (0.67) TSHRCES2NAAAEPHX1LPAR1
SCHEMBL8989603 0.67 TSHR (0.67) TSHRCES2NAAAEPHX1LPAR1

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
EP-0289933-A2 Graft polymerization precurser and method manufacturing the same NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1988-11-09 EP disclosed
EP-0277608-A2 Graft polymerization preformer and method of manufacturing the same NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1988-08-10 EP disclosed