SCHEMBL12393928

SCHEMBL12393928

CC/C=C\CC/C=C/CNC(=O)OCCOC

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 2/20 0.44
▸ HRH3 Q9Y5N1 2/20 0.44
▸ ACHE P22303 7/20 0.40
▸ EPHX2 P34913 2/20 0.36
▸ LPAR2 Q9HBW0 2/20 0.35
▸ LPAR3 Q9UBY5 2/20 0.35
▸ LPAR1 Q92633 1/20 0.35
▸ CNR1 P21554 1/20 0.35
▸ PTGS1 P23219 1/20 0.34

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
SCHEMBL12393900 0.87 HRH4 (0.46) HRH4HRH3ACHEEPHX2PTGS1
SCHEMBL12393930 0.86 HRH4 (0.46) HRH4HRH3ACHEEPHX2PTGS1
SCHEMBL12393903 0.84 HRH4 (0.50) HRH4HRH3ACHEEPHX2
SCHEMBL12393927 0.84 HRH4 (0.41) HRH4HRH3ACHEEPHX2CNR1
SCHEMBL12393899 0.83 NR1I2 (0.45) HRH4HRH3CNR1PTGS1
SCHEMBL12393895 0.83 PTGS1 (0.40) HRH4HRH3EPHX2CNR1PTGS1
SCHEMBL12393923 0.83 HRH4 (0.41) HRH4HRH3ACHEEPHX2PTGS1
SCHEMBL12393935 0.81 HRH4 (0.38) HRH4HRH3ACHEEPHX2CNR1
SCHEMBL12393932 0.81 CHRNB2 (0.39) HRH4HRH3ACHEEPHX2PTGS1
SCHEMBL12393939 0.80 HRH4 (0.39) HRH4HRH3ACHEEPHX2CNR1

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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