SCHEMBL8623312

SCHEMBL8623312

CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COC(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.58
LMNA P02545 1/20 0.58
TRPV1 Q8NER1 2/20 0.53
ALDH1A1 P00352 1/20 0.48
ALOX15 P16050 1/20 0.48

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
SCHEMBL8623318 1.00 KDM4E (0.58) KDM4ELMNATRPV1ALDH1A1ALOX15
SCHEMBL4957845 0.85 TRPV1 (0.66) TRPV1ALDH1A1ALOX15
SCHEMBL8619719 0.82 TRPV1 (0.60) LMNATRPV1ALDH1A1ALOX15
SCHEMBL6072531 0.82 TRPV1 (0.59) TRPV1ALDH1A1ALOX15
SCHEMBL8619715 0.82 TRPV1 (0.60) LMNATRPV1ALDH1A1ALOX15
SCHEMBL2639492 0.81 TRPV1 (0.61) TRPV1ALDH1A1ALOX15
SCHEMBL2639495 0.81 TRPV1 (0.61) TRPV1ALDH1A1ALOX15
SCHEMBL13532227 0.81 TRPV1 (0.57) TRPV1ALDH1A1ALOX15
SCHEMBL3177901 0.81 TRPV1 (0.57) TRPV1ALDH1A1ALOX15
SCHEMBL5069002 0.81 TRPV1 (0.57) LMNATRPV1ALDH1A1ALOX15

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