SCHEMBL12290402

SCHEMBL12290402

C=C1N(c2cnn(Cc3c(C)noc3C)c2)C(=O)C(Cc2ccccc2)N1C

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TAS2R8 Q9NYW2 20/20 0.84

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
SCHEMBL1279459 0.92 TAS2R8 (1.00) TAS2R8
SCHEMBL12290404 0.83 TAS2R8 (0.84) TAS2R8
SCHEMBL10248683 0.82 TAS2R8 (0.76) TAS2R8
SCHEMBL1279296 0.80 TAS2R8 (1.00) TAS2R8
SCHEMBL1279358 0.80 TAS2R8 (1.00) TAS2R8
SCHEMBL1279300 0.80 TAS2R8 (1.00) TAS2R8
SCHEMBL13940245 0.80 TAS2R8 (0.69) TAS2R8
SCHEMBL18351057 0.80 TAS2R8 (0.69) TAS2R8
SCHEMBL18351067 0.80 TAS2R8 (0.69) TAS2R8
SCHEMBL18351077 0.80 TAS2R8 (0.69) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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