SCHEMBL8621095

SCHEMBL8621095

CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOC(=O)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.60
MAPT P10636 1/20 0.60
TRPV1 Q8NER1 2/20 0.57
ADRB2 P07550 2/20 0.49
ADRB1 P08588 2/20 0.49
ADRB3 P13945 2/20 0.49
ALDH1A1 P00352 2/20 0.48
ICMT O60725 1/20 0.48
ALOX15 P16050 1/20 0.46

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
SCHEMBL8621087 1.00 POLB (0.60) POLBMAPTTRPV1ADRB2ADRB1
SCHEMBL14826012 0.89 TRPV1 (0.58) POLBMAPTTRPV1ALDH1A1ICMT
SCHEMBL14815393 0.89 TRPV1 (0.58) POLBMAPTTRPV1ALDH1A1ICMT
SCHEMBL7224157 0.87 TRPV1 (0.60) POLBMAPTTRPV1ALDH1A1ICMT
SCHEMBL7224161 0.87 TRPV1 (0.60) POLBMAPTTRPV1ALDH1A1ICMT
SCHEMBL8626153 0.86 TRPV1 (0.69) MAPTTRPV1ADRB2ADRB1ADRB3
SCHEMBL8855956 0.86 TRPV1 (0.69) MAPTTRPV1ADRB2ADRB1ADRB3
SCHEMBL8626157 0.86 TRPV1 (0.69) MAPTTRPV1ADRB2ADRB1ADRB3
SCHEMBL8855850 0.86 TRPV1 (0.69) MAPTTRPV1ADRB2ADRB1ADRB3
4-Nitrobenzoic Acid SCHEMBL8855884 0.82 TRPV1 (0.63) MAPTTRPV1ALDH1A1ALOX15

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