SCHEMBL3365088

SCHEMBL3365088

C=CCN(C)CCCCCCOc1ccc(N(C)S(=O)(=O)NCCc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LSS P48449 9/20 0.55
LTA4H P09960 1/20 0.41
MAOB P27338 3/20 0.41
MAOA P21397 2/20 0.41

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
SCHEMBL3365370 0.90 LSS (0.57) LSSLTA4HMAOBMAOA
SCHEMBL3367439 0.84 LSS (0.59) LSS
SCHEMBL3366362 0.83 LSS (0.60) LSSLTA4HMAOBMAOA
Benzene SCHEMBL3366287 0.81 LSS (0.63) LSS
SCHEMBL3364873 0.81 LSS (0.52) LSS
SCHEMBL3364883 0.81 LSS (0.60) LSSLTA4H
SCHEMBL3365335 0.81 LSS (0.62) LSS
SCHEMBL3368392 0.80 LSS (0.56) LSSLTA4H
SCHEMBL3365561 0.79 LSS (0.48) LSS
SCHEMBL3365682 0.78 LSS (0.53) LSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1303503-B1 ANILINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-01-27 EP disclosed
EP-1303503-A2 ANILINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-04-23 EP disclosed
WO-2002006189-A2 ANILINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-01-24 WO disclosed