SCHEMBL8620646

SCHEMBL8620646

CC(C)=CCC/C(C)=C/CC(/C=C(\C)CCC=C(C)C)OC(=O)c1ccc2ccccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.42
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
UTS2R Q9UKP6 1/20 0.39
FNTA P49354 1/20 0.39
FNTB P49356 1/20 0.39
PGR P06401 1/20 0.38
HTR1A P08908 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
MAPT P10636 1/20 0.38
PTGS1 P23219 1/20 0.38
PDE4A P27815 1/20 0.38
MAPK1 P28482 1/20 0.38
DRD3 P35462 1/20 0.38
SNCA P37840 1/20 0.38
PDE3A Q14432 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
SCHEMBL6445161 0.86 TRPV1 (0.47) TRPV1FNTAFNTBPGRHTR1A
SCHEMBL8625198 0.84 TRPV1 (0.46) TRPV1FNTAFNTBPGRHTR1A
SCHEMBL8618525 0.84 TRPV1 (0.50) TRPV1FNTAFNTBMAPT
SCHEMBL8622897 0.83 TRPV1 (0.49) TRPV1FNTAFNTBICMT
SCHEMBL8618289 0.83 TRPV1 (0.49) TRPV1FNTAFNTB
SCHEMBL8624110 0.83 ALOX15 (0.39) TRPV1FNTAFNTBPGRHTR1A
SCHEMBL8622892 0.82 TRPV1 (0.48) TRPV1FNTAFNTB
SCHEMBL8624938 0.81 TRPV1 (0.43) TRPV1FNTAFNTBPGRHTR1A
SCHEMBL8625201 0.80 ICMT (0.40) TRPV1ADRB2ADRB1ADRB3UTS2R
SCHEMBL8621083 0.79 MAPT (0.55) ADRB2ADRB1ADRB3MAPTICMT

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