SCHEMBL8622897

SCHEMBL8622897

COc1ccc(C(=O)OC(/C=C(\C)CCC=C(C)C)C/C=C(\C)CCC=C(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.49
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
PTGES O14684 1/20 0.39
ICMT O60725 1/20 0.38

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
SCHEMBL8618289 0.91 TRPV1 (0.49) TRPV1FNTAFNTBCA1CA2
SCHEMBL8618525 0.89 TRPV1 (0.50) TRPV1PPARGPPARAFNTAFNTB
SCHEMBL8622892 0.87 TRPV1 (0.48) TRPV1FNTAFNTBPTGES
SCHEMBL6445161 0.87 TRPV1 (0.47) TRPV1FNTAFNTBICMT
SCHEMBL8646997 0.86 TRPV1 (0.46) TRPV1FNTAFNTBICMT
SCHEMBL8625198 0.85 TRPV1 (0.46) TRPV1FNTAFNTBICMT
SCHEMBL8619801 0.84 TRPV1 (0.46) TRPV1FNTAFNTB
SCHEMBL8624125 0.84 TRPV1 (0.46) TRPV1PPARGPPARAFNTAFNTB
SCHEMBL8620646 0.83 TRPV1 (0.42) TRPV1FNTAFNTBICMT
SCHEMBL8626149 0.83 MAPT (0.52) TRPV1FNTAFNTBICMT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0711749-B1 Process for producing geranylgeraniol KURARAY CO (JP) 1998-05-20 EP disclosed
US-5663461-A HYDROLYSIS OF ESTER KURARAY CO., LTD. (JP) 1997-09-02 US disclosed
EP-0711749-A1 Process for producing geranylgeraniol KURARAY CO., LTD. (JP) 1996-05-15 EP disclosed