SCHEMBL19370487

SCHEMBL19370487

C=C/C(=C\C=C/C)CC(C)C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.35
GRIK2 Q13002 1/20 0.35
FFAR1 O14842 1/20 0.31

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
SCHEMBL23961148 0.83 FFAR1 (0.31) FFAR1
SCHEMBL20997460 0.80 GRIK1 (0.32) GRIK1GRIK2
SCHEMBL13881101 0.80 GRIK1 (0.42) GRIK1GRIK2
SCHEMBL25018252 0.80 GRIK1 (0.32) GRIK1GRIK2
SCHEMBL18494068 0.79 TSHR (0.32)
SCHEMBL17308573 0.76 GRIK1 (0.42) GRIK1GRIK2
SCHEMBL23609757 0.76 TSHR (0.30)
SCHEMBL24501833 0.75 GRIK1 (0.62) GRIK1GRIK2
SCHEMBL22060227 0.75 GRIK1 (0.62) GRIK1GRIK2
SCHEMBL20825132 0.75 GRIK1 (0.38) GRIK1GRIK2

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
US-9763955-B2 Methods and compositions for decreasing gastric emptying PURDUE PHARMA L.P. (US) 2017-09-19 US disclosed