SCHEMBL12393903

SCHEMBL12393903

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

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 2/20 0.50
▸ HRH3 Q9Y5N1 2/20 0.50
▸ ACHE P22303 12/20 0.49
▸ EPHX2 P34913 2/20 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
SCHEMBL12393900 0.90 HRH4 (0.46) HRH4HRH3ACHEEPHX2
SCHEMBL12393927 0.84 HRH4 (0.41) HRH4HRH3ACHEEPHX2
SCHEMBL12393928 0.84 HRH4 (0.44) HRH4HRH3ACHEEPHX2
SCHEMBL12393899 0.83 NR1I2 (0.45) HRH4HRH3
SCHEMBL12393930 0.83 HRH4 (0.46) HRH4HRH3ACHEEPHX2
SCHEMBL12393923 0.83 HRH4 (0.41) HRH4HRH3ACHEEPHX2
SCHEMBL31113456 0.82 ACHE (0.50) HRH4HRH3ACHEEPHX2
SCHEMBL30010462 0.82 ACHE (0.50) HRH4HRH3ACHEEPHX2
SCHEMBL22121365 0.82 ACHE (0.50) HRH4HRH3ACHE
SCHEMBL22121364 0.82 ACHE (0.50) HRH4HRH3ACHE

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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