SCHEMBL7212189

SCHEMBL7212189

C=CCN(C)CCCCOc1ccc2c(c1)C(C(=O)c1ccc(C(F)(F)F)cc1)CN2

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LSS P48449 19/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL7218468 0.91 LSS (0.61) LSSMEN1KMT2A
SCHEMBL7218481 0.89 LSS (0.54) LSSMEN1KMT2A
SCHEMBL7212163 0.89 LSS (0.61) LSSMEN1KMT2A
SCHEMBL7217117 0.89 LSS (0.58) LSSMEN1KMT2A
SCHEMBL7212194 0.85 LSS (0.52) LSSMEN1KMT2A
SCHEMBL6992807 0.82 LSS (0.46) LSSMEN1KMT2A
SCHEMBL7217099 0.82 LSS (0.51) LSSMEN1KMT2A
SCHEMBL7218507 0.81 LSS (0.46) LSSMEN1KMT2A
SCHEMBL7218350 0.78 LSS (0.43) LSSMEN1KMT2A
SCHEMBL7218367 0.77 LSS (0.46) 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-1358162-A1 DIHYDROINDOLE AND TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-11-05 EP disclosed
WO-2002050041-A1 DIHYDROINDOLE AND TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-06-27 WO disclosed