SCHEMBL13513799

SCHEMBL13513799

C=CCC(C(=O)CC)[C@H]1CCN(Cc2cc(C(F)(F)F)ccc2C(F)(F)F)[C@@H](C2C=CC(C(F)(F)F)=CC2)C1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 18/20 0.35
▸ TEAD1 P28347 2/20 0.32

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
SCHEMBL13611585 0.91 FFAR1 (0.35) FFAR1
SCHEMBL8268701 0.85 FFAR1 (0.39) FFAR1
SCHEMBL13611504 0.83 FFAR1 (0.37) FFAR1
SCHEMBL8268224 0.79 FFAR1 (0.33) FFAR1
SCHEMBL13611611 0.78 FFAR4 (0.42) FFAR1
SCHEMBL13611438 0.77 FFAR1 (0.39) FFAR1
SCHEMBL13611501 0.75 FFAR1 (0.37) FFAR1
SCHEMBL8268942 0.75 FFAR1 (0.41) FFAR1
SCHEMBL13611623 0.74 FFAR1 (0.36) FFAR1
SCHEMBL8268243 0.74 FFAR1 (0.36) 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
EP-1805141-B1 PIPERIDINES AND RELATED COMPOUNDS FOR TREATMENT OF ALZHEIMER'S DISEASE MERCK SHARP & DOHME (GB) 2010-01-20 — — EP disclosed
Send feedback