SCHEMBL11923819

SCHEMBL11923819

C=C1NC(CCCc2ccccc2)C(=O)N1c1cnn(Cc2c(C)noc2C)c1

nearest known ligand 0.87

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TAS2R8 Q9NYW2 20/20 0.87

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
SCHEMBL12289315 0.95 TAS2R8 (0.86) TAS2R8
SCHEMBL1279039 0.93 TAS2R8 (1.00) TAS2R8
SCHEMBL1279090 0.88 TAS2R8 (1.00) TAS2R8
SCHEMBL12291999 0.86 TAS2R8 (0.87) TAS2R8
SCHEMBL12289821 0.84 TAS2R8 (0.85) TAS2R8
SCHEMBL11923500 0.84 TAS2R8 (0.82) TAS2R8
SCHEMBL13939296 0.83 TAS2R8 (0.74) TAS2R8
SCHEMBL1279296 0.82 TAS2R8 (1.00) TAS2R8
SCHEMBL1279300 0.82 TAS2R8 (1.00) TAS2R8
SCHEMBL1279358 0.82 TAS2R8 (1.00) TAS2R8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2487169-A1 Compounds that inhibit (block) bitter taste in compositions and use thereof Senomyx Inc. (US) 2012-08-15 EP disclosed
WO-2011106114-A1 IDENTIFICATION OF HUMAN T2R RECEPTORS AND THE USE THEREOF TO IDENTIFY INHIBITORS (BLOCKERS) OF BITTER TASTE SENOMYX, INC. (US) 2011-09-01 WO disclosed