SCHEMBL3945562

SCHEMBL3945562

O=C(O)NCCC1CCN(Cc2ccc(-c3ccc(F)cc3)cc2Cl)CC1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 10/20 0.59
ACHE P22303 3/20 0.50
BCHE P06276 1/20 0.50
CHRM2 P08172 3/20 0.48
CHRM1 P11229 2/20 0.48
CHRM5 P08912 1/20 0.48
CHRM3 P20309 1/20 0.48
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46

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
SCHEMBL3941799 0.91 CHRM4 (0.53) CHRM4ACHEBCHECHRM2
SCHEMBL3592322 0.89 POLB (0.50) CHRM4ACHEBCHE
SCHEMBL3935459 0.89 CHRM4 (0.59) CHRM4ACHEBCHECHRM2CHRM1
SCHEMBL3939238 0.85 CHRM4 (0.53) CHRM4ACHEBCHECHRM2
SCHEMBL3937038 0.85 CHRM4 (0.52) CHRM4ACHEBCHE
SCHEMBL2974797 0.83 CHRM4 (0.49) CHRM4ACHEBCHECHRM2CHRM1
SCHEMBL3946467 0.78 ACHE (0.52) CHRM4ACHECHRM2
SCHEMBL3589414 0.78 KMT2A (0.53) CHRM4ACHEBCHE
SCHEMBL3937725 0.78 MAOA (0.52) CHRM4ACHEBCHE
SCHEMBL3592324 0.77 ACHE (0.47) ACHE

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-1720550-B1 DERIVATIVES OF PIPERIDINYLALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2009-04-15 EP claimed
EP-1720550-B1 DERIVATIVES OF PIPERIDINYLALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2009-04-15 EP disclosed