SCHEMBL2490736

SCHEMBL2490736

CSC(=NC(=O)C(CCCCCl)c1ccc(F)cc1)Nc1cc(F)c(-c2nc(Cl)c[nH]2)c(F)c1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 2/20 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
SCHEMBL961342 0.80 SLC6A3 (0.31) SLC6A3
SCHEMBL961349 0.76 PSEN1 (0.33)
SCHEMBL961340 0.70 PSEN1 (0.38)
SCHEMBL960585 0.69 PSEN1 (0.42)
SCHEMBL963213 0.69 AAK1 (0.37)
SCHEMBL963212 0.69 F11 (0.36)
SCHEMBL960939 0.66 AR (0.33)
SCHEMBL962540 0.61 POLB (0.41) SLC6A3
SCHEMBL961183 0.58 POLB (0.41) SLC6A3
SCHEMBL827946 0.57 SMARCA2 (0.38) SLC6A3

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-2379553-A1 BICYCLIC COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION Bristol-Myers Squibb Company (US) 2011-10-26 EP disclosed
WO-2010083141-A1 BICYCLIC COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2010-07-22 WO disclosed