SCHEMBL528590

SCHEMBL528590

Cc1ccc(N(Cc2ccc(NC(=O)c3cccc(F)c3)cc2)S(=O)(=O)c2ccccc2)cc1C

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.63
LMNA P02545 5/20 0.63
ALDH1A1 P00352 3/20 0.53
KDM4E B2RXH2 2/20 0.53
KMT2A Q03164 3/20 0.50
HTT P42858 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HPGD P15428 1/20 0.49
MEN1 O00255 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
GAA P10253 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
GFER P55789 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
SCHEMBL529003 0.91 MAPT (0.66) MAPTLMNAALDH1A1KDM4EKMT2A
SCHEMBL528683 0.91 MAPT (0.77) MAPTLMNAALDH1A1KDM4EKMT2A
SCHEMBL531055 0.91 MAPT (0.71) MAPTLMNAALDH1A1KDM4EHTT
SCHEMBL528499 0.89 MAPT (0.63) MAPTLMNAALDH1A1KDM4EKMT2A
SCHEMBL528754 0.89 MAPT (0.56) MAPTLMNAALDH1A1KDM4EKMT2A
SCHEMBL528010 0.88 SMN1; SMN2 (0.52) MAPTLMNAALDH1A1KDM4EKMT2A
SCHEMBL529032 0.87 MAPT (0.77) MAPTLMNAALDH1A1KDM4EKMT2A
SCHEMBL527884 0.87 MAPT (0.74) MAPTLMNAALDH1A1KDM4EHTT
SCHEMBL527969 0.86 MAPT (0.60) MAPTLMNAALDH1A1KDM4EKMT2A
SCHEMBL528794 0.86 MAPT (0.62) MAPTLMNAALDH1A1KDM4EKMT2A

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