SCHEMBL10699697

SCHEMBL10699697

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

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
CES2 O00748 1/20 0.34
FAAH O00519 6/20 0.34
HCAR2 Q8TDS4 2/20 0.34
LMNA P02545 2/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
NAAA Q02083 1/20 0.32
LCK P06239 1/20 0.31
PPARD Q03181 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31
PLA2G2C Q5R387 2/20 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
SCHEMBL10697528 0.99 TSHR (0.33) TSHRCES2FAAHHCAR2LMNA
SCHEMBL9863427 0.94 ALDH1A1 (0.33) FAAHHCAR2
SCHEMBL10699687 0.90 TSHR (0.36) TSHRCES2FAAHHCAR2LMNA
SCHEMBL10716083 0.89 ALDH1A1 (0.31)
SCHEMBL10697521 0.89 TSHR (0.34) TSHRCES2FAAHHCAR2LMNA
SCHEMBL9863420 0.85 ALDH1A1 (0.33) TSHRFAAHCNR1CNR2
SCHEMBL10699694 0.79 TSHR (0.45) TSHRCES2FAAHHCAR2NAAA
SCHEMBL10697523 0.77 TSHR (0.42) TSHRCES2FAAHHCAR2NAAA
SCHEMBL10697692 0.76 TSHR (0.36) TSHRCES2FAAHHCAR2NAAA
SCHEMBL10700658 0.75 TSHR (0.41) TSHRCES2HCAR2LMNANAAA

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