SCHEMBL6597580

SCHEMBL6597580

CCOC(C)OCC.O=CCSc1cc(F)ccc1Br

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.31

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
SCHEMBL6595280 0.90 LMNA (0.31) LMNA
SCHEMBL6591548 0.77 LMNA (0.31) LMNA
SCHEMBL6597582 0.75 MAOA (0.34)
SCHEMBL5424199 0.71 LMNA (0.38) LMNA
SCHEMBL30178495 0.71 LMNA (0.38) LMNA
Ethylene Glycol SCHEMBL6597178 0.68 MAOA (0.44)
SCHEMBL5153336 0.67 MAOA (0.47) LMNA
SCHEMBL7563021 0.67 LMNA (0.43) LMNA
SCHEMBL3598536 0.66 MAOA (0.36)
SCHEMBL29391079 0.66 CES2 (0.35)

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-1204660-B1 SEROTONERGIC BENZOTHIOPHENES LILLY CO ELI (US) 2004-10-20 EP disclosed