SCHEMBL8269013

SCHEMBL8269013

CCC[C@H]1C[C@H](CC(=O)OCC)C[C@H](C2C=CC(C(F)(F)F)=CC2)N1Cc1cc(C(F)(F)F)ccc1C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 3/20 0.31
▸ CCRL2 O00421 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
SCHEMBL8269012 1.00 FFAR1 (0.31) FFAR1CCRL2
SCHEMBL8269240 0.91 FFAR4 (0.35) FFAR1
SCHEMBL8269244 0.91 FFAR4 (0.35) FFAR1
SCHEMBL13611630 0.91 FFAR4 (0.35) FFAR1
SCHEMBL13611866 0.87 — —
SCHEMBL13611867 0.87 — —
SCHEMBL13513844 0.85 FFAR4 (0.37) FFAR1
SCHEMBL8268251 0.83 — —
SCHEMBL13513845 0.80 ALDH1A1 (0.34) FFAR1CCRL2
SCHEMBL13604442 0.80 ALDH1A1 (0.34) FFAR1CCRL2

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-1805141-B1 PIPERIDINES AND RELATED COMPOUNDS FOR TREATMENT OF ALZHEIMER'S DISEASE MERCK SHARP & DOHME (GB) 2010-01-20 — — EP disclosed
WO-2006043064-A1 PIPERIDINES AND RELATED COMPOUNDS FOR TREATMENT OF ALZHEIMER'S DISEASE MERCK SHARP & DOHME LIMITED (GB) 2006-04-27 — — WO disclosed
Send feedback