SCHEMBL10697692

SCHEMBL10697692

CCCCCCOOC=C(C)C(=O)OC(C)(C)OC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.36
CES2 O00748 2/20 0.34
HCAR2 Q8TDS4 2/20 0.34
FAAH O00519 2/20 0.33
THRA P10827 2/20 0.32
THRB P10828 2/20 0.32
GMNN O75496 1/20 0.32
USP2 O75604 1/20 0.32
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
APEX1 P27695 1/20 0.32
CYP2C19 P33261 1/20 0.32
RECQL P46063 1/20 0.32
BLM P54132 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NAAA Q02083 1/20 0.32
S1PR1 P21453 1/20 0.31

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
SCHEMBL10698706 0.99 TSHR (0.33) TSHRCES2HCAR2FAAHTHRA
SCHEMBL10697688 0.90 TSHR (0.36) TSHRCES2HCAR2FAAHNAAA
SCHEMBL10699694 0.79 TSHR (0.45) TSHRCES2HCAR2FAAHNAAA
SCHEMBL10697523 0.77 TSHR (0.42) TSHRCES2HCAR2FAAHNAAA
SCHEMBL10698748 0.76 ALDH1A1 (0.33) TSHR
SCHEMBL10699697 0.76 TSHR (0.36) TSHRCES2HCAR2FAAHNAAA
SCHEMBL1581663 0.75 NAAA (0.40) TSHRCES2HCAR2HSD17B10NAAA
SCHEMBL10697528 0.74 TSHR (0.33) TSHRCES2HCAR2FAAH
SCHEMBL8762563 0.73
SCHEMBL8593909 0.73 NAAA (0.37) TSHRCES2HCAR2GMNNUSP2

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