SCHEMBL12393880

SCHEMBL12393880

CCOCCOC(=O)NC/C=C(/C)CCC=C(C)C

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 1/20 0.53
▸ TRPA1 O75762 1/20 0.49
▸ TRPV1 Q8NER1 5/20 0.48
▸ FNTA P49354 5/20 0.47
▸ FNTB P49356 3/20 0.47
▸ PGGT1B P53609 3/20 0.47
▸ ALDH1A1 P00352 1/20 0.45
▸ ALOX15 P16050 1/20 0.45

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
SCHEMBL12393822 1.00 HRH3 (0.53) HRH3TRPA1TRPV1FNTAFNTB
SCHEMBL12393843 0.87 TRPA1 (0.52) HRH3TRPA1TRPV1FNTAFNTB
SCHEMBL12393786 0.87 TRPA1 (0.52) HRH3TRPA1TRPV1FNTAFNTB
SCHEMBL12393840 0.87 TRPA1 (0.55) HRH3TRPA1TRPV1FNTAFNTB
SCHEMBL12393785 0.87 TRPA1 (0.55) HRH3TRPA1TRPV1FNTAFNTB
SCHEMBL12393878 0.86 HRH3 (0.53) HRH3TRPA1TRPV1FNTAFNTB
SCHEMBL12393821 0.86 HRH3 (0.53) HRH3TRPA1TRPV1FNTAFNTB
SCHEMBL12393789 0.84 HRH3 (0.54) HRH3TRPA1TRPV1FNTAFNTB
SCHEMBL12393849 0.84 HRH3 (0.54) HRH3TRPA1TRPV1FNTAFNTB
SCHEMBL12393877 0.83 TRPA1 (0.51) HRH3TRPA1TRPV1FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1803357-B1 Unsaturated cyclic and acyclic carbamates exhibiting taste and flavor enhancement effect in flavor compositions INT FLAVORS & FRAGRANCES INC (US) 2015-08-19 — — EP disclosed
US-8007849-B2 Unsaturated cyclic and acyclic carbamates exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2011-08-30 — — US disclosed
US-8007849-B2 Unsaturated cyclic and acyclic carbamates exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2011-08-30 — — US disclosed
EP-1803357-A1 Unsaturated cyclic and acyclic carbamates exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES, INC. (US) 2007-07-04 — — EP disclosed
US-20070134389-A1 Unsaturated cyclic and acyclic carbamates exhibiting taste and flavor enhancement effect in flavor compositions PEI TAO 2007-06-14 — — US disclosed
US-20070134389-A1 Unsaturated cyclic and acyclic carbamates exhibiting taste and flavor enhancement effect in flavor compositions PEI TAO 2007-06-14 — — US disclosed
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