SCHEMBL539192

SCHEMBL539192

Cc1ccc(N(Cc2ccc(C(=O)Nc3cc(Cl)ccc3C)cc2)S(=O)(=O)c2cn(C)cn2)cc1C

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
LMNA P02545 5/20 0.49
KDM4E B2RXH2 4/20 0.45
ALDH1A1 P00352 6/20 0.44
HTT P42858 3/20 0.44
HPGD P15428 5/20 0.43
POLB P06746 2/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
F10 P00742 2/20 0.39
GAA P10253 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL529212 0.92 NPSR1 (0.48) MAPTSMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL527937 0.86 ALDH1A1 (0.48) MAPTSMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL529354 0.85 MAPT (0.55) MAPTSMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL528549 0.84 MAPT (0.56) MAPTSMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL528306 0.82 KDM4E (0.67) MAPTSMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL528797 0.81 MAPT (0.51) MAPTSMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL528332 0.81 ALDH1A1 (0.51) MAPTSMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL528225 0.81 MAPT (0.46) MAPTSMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL528351 0.78 MAPT (0.48) MAPTSMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL3281840 0.77 KMT2A (0.51) KDM4EALDH1A1HPGDMEN1KMT2A

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