SCHEMBL5509372

SCHEMBL5509372

FC(F)(F)Oc1cccc(CNCC2C3CN(Cc4ccc(-c5ccccc5)cc4)CC23)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.45
BCHE P06276 2/20 0.45
ACHE P22303 2/20 0.45
DRD4 P21917 1/20 0.45
CARM1 Q86X55 3/20 0.45
PRMT6 Q96LA8 3/20 0.45
CTSD P07339 1/20 0.44
CHRM4 P08173 3/20 0.44
CETP P11597 2/20 0.43
CHRM3 P20309 1/20 0.41
CHRM5 P08912 2/20 0.41
TEAD1 P28347 1/20 0.41
HTR5A P47898 1/20 0.41
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
S1PR5 Q9H228 1/20 0.40

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
SCHEMBL5511194 0.92 MAPK14 (0.49) BACE1BCHEACHEDRD4CARM1
SCHEMBL712568 0.92 BACE1 (0.48) BACE1BCHEACHEDRD4CARM1
SCHEMBL708522 0.91 CARM1 (0.50) BACE1BCHEACHEDRD4CARM1
SCHEMBL5512185 0.90 CARM1 (0.48) BACE1BCHEACHEDRD4CARM1
SCHEMBL5514659 0.90 CARM1 (0.46) BACE1BCHEACHEDRD4CARM1
SCHEMBL5510930 0.90 CARM1 (0.46) BACE1BCHEACHEDRD4CARM1
SCHEMBL708602 0.89 CARM1 (0.45) BACE1BCHEACHEDRD4CARM1
SCHEMBL15967011 0.89 CARM1 (0.48) BACE1BCHEACHEDRD4CARM1
SCHEMBL5513313 0.88 CARM1 (0.47) BACE1BCHEACHEDRD4CARM1
SCHEMBL5506387 0.88 HDAC3 (0.46) BACE1BCHEACHEDRD4CARM1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP claimed
EP-1869019-A1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS Pfizer Products Incorporated (US) 2007-12-26 EP claimed
WO-2006106425-A1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PRODUCTS INC. (US) 2006-10-12 WO claimed
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP disclosed