SCHEMBL7149874

SCHEMBL7149874

C=CCN(C)CCCCCCOc1ccc(N(C)C(=S)NCCc2ccc(F)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LSS P48449 14/20 0.58
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LTA4H P09960 1/20 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
SCHEMBL3367112 0.91 LSS (0.48) LSSMEN1KMT2A
SCHEMBL3369265 0.91 LSS (0.47) LSS
SCHEMBL3368392 0.90 LSS (0.56) LSSMEN1KMT2ALTA4H
SCHEMBL3367117 0.90 LSS (0.60) LSSMEN1KMT2ALTA4H
SCHEMBL3368101 0.86 LSS (0.55) LSSLTA4H
SCHEMBL3369726 0.84 LSS (0.52) LSSMEN1KMT2A
SCHEMBL3364788 0.84 LSS (0.52) LSSMEN1KMT2A
SCHEMBL3367508 0.83 LSS (0.51) LSSMEN1KMT2A
SCHEMBL3362796 0.83 LSS (0.66) LSSMEN1KMT2A
SCHEMBL3364796 0.83 LSS (0.55) LSSMEN1KMT2A

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-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