SCHEMBL10698196

SCHEMBL10698196

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

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
CES2 O00748 2/20 0.39
NAAA Q02083 1/20 0.36
HCAR2 Q8TDS4 1/20 0.35
LMNA P02545 2/20 0.34
EPHX1 P07099 1/20 0.34
PLA2G2C Q5R387 3/20 0.34
PLA2G2A P14555 1/20 0.33
TP53 P04637 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
SCHEMBL10698322 0.94 ALDH1A1 (0.37) TSHRCES2HCAR2
SCHEMBL10698192 0.89 TSHR (0.45) TSHRCES2NAAALMNAEPHX1
SCHEMBL10698317 0.82 ALDH1A1 (0.38) TSHRCES2LMNAPLA2G2C
SCHEMBL10456591 0.75 HCAR2 (0.38) TSHRCES2NAAAHCAR2LMNA
SCHEMBL30595889 0.72 LMNA (0.37) TSHRCES2NAAAHCAR2LMNA
SCHEMBL10699703 0.72 TSHR (0.51) TSHRCES2NAAAHCAR2LMNA
SCHEMBL11224059 0.71 SMPD1 (0.42)
SCHEMBL9852414 0.71 HCAR2 (0.46) TSHRCES2NAAAHCAR2EPHX1
SCHEMBL28586771 0.70 GPR84 (0.44) TSHRLMNA
SCHEMBL15914715 0.70 PLA2G2C (0.35) CES2NAAAHCAR2LMNAEPHX1

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