SCHEMBL13636136

SCHEMBL13636136

Bc1ccc(CC(OCC)OCC)cc1F

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.30
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30

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
SCHEMBL5761123 0.75 IDO1 (0.47) FFAR1PPARGPPARA
SCHEMBL5758636 0.74 TRPA1 (0.47) PPARGPPARA
SCHEMBL12820168 0.72 CNR1 (0.44)
SCHEMBL18747194 0.68 HTR2A (0.48) PPARA
SCHEMBL19546875 0.67 LOXL2 (0.46)
SCHEMBL10187262 0.67 NQO1 (0.50) FFAR1
SCHEMBL5710979 0.66 TAAR1 (0.52) PPARA
SCHEMBL13516238 0.66 PPARA (0.42) PPARGPPARA
SCHEMBL24036410 0.66 PPARD (0.32) FFAR1PPARA
SCHEMBL12655428 0.66 HRH4 (0.32) FFAR1

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-2009143211-A2 SALTS OF 2-FLUORO-N-METHYL-4-[7-(QUINOLIN-6-YL-METHYL)- IMIDAZO[1,2-B][1,2,4]TRIAZIN-2-YL]BENZAMIDE AND PROCESSES RELATED TO PREPARING THE SAME INCYTE CORPORATION (US) 2009-11-26 WO disclosed