SCHEMBL528386

SCHEMBL528386

Cc1ccc(N(Cc2ccc(NC(=O)c3ccc(F)c(C)c3)cc2)S(C)(=O)=O)cc1C

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 5/20 0.53
LMNA P02545 4/20 0.53
NPSR1 Q6W5P4 3/20 0.52
ALDH1A1 P00352 6/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
KCNH2 Q12809 1/20 0.51
HPGD P15428 2/20 0.51
KDM4E B2RXH2 1/20 0.51
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
GAA P10253 2/20 0.46

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
SCHEMBL528646 0.90 ALDH1A1 (0.59) MAPTHTTSMN1; SMN2LMNANPSR1
SCHEMBL528307 0.88 KMT2A (0.63) MAPTHTTSMN1; SMN2LMNANPSR1
SCHEMBL529360 0.87 LMNA (0.67) MAPTHTTSMN1; SMN2LMNANPSR1
SCHEMBL528754 0.87 MAPT (0.56) MAPTHTTSMN1; SMN2LMNANPSR1
SCHEMBL528550 0.87 ALDH1A1 (0.55) MAPTHTTSMN1; SMN2LMNANPSR1
SCHEMBL529239 0.86 MAPT (0.55) MAPTHTTSMN1; SMN2LMNANPSR1
SCHEMBL528714 0.85 SMN1; SMN2 (0.57) MAPTHTTSMN1; SMN2LMNANPSR1
SCHEMBL528077 0.85 SMN1; SMN2 (0.57) MAPTHTTSMN1; SMN2LMNANPSR1
SCHEMBL528058 0.85 MEN1 (0.67) MAPTHTTSMN1; SMN2LMNANPSR1
SCHEMBL528337 0.85 MAPT (0.56) MAPTHTTSMN1; SMN2LMNANPSR1

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
WO-2012014127-A1 5-LIPOXYGENASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-02-02 WO disclosed