SCHEMBL528797

SCHEMBL528797

CCS(=O)(=O)N(Cc1ccc(C(=O)Nc2cc(Cl)ccc2C)cc1)c1ccc(C)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.51
HTT P42858 2/20 0.51
KDM4E B2RXH2 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
LMNA P02545 4/20 0.50
HPGD P15428 4/20 0.49
ALDH1A1 P00352 4/20 0.49
POLB P06746 3/20 0.47
NPSR1 Q6W5P4 2/20 0.47
GAA P10253 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KCNH2 Q12809 1/20 0.44

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
SCHEMBL528511 0.89 KMT2A (0.52) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL528306 0.86 KDM4E (0.67) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL528351 0.86 MAPT (0.48) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL528805 0.84 MAPT (0.58) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL529168 0.84 MAPT (0.55) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL529259 0.82 MAPT (0.55) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL528111 0.82 MAPT (0.48) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL528121 0.82 MAPT (0.75) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL528626 0.82 ALDH1A1 (0.46) MAPTHTTSMN1; SMN2LMNAHPGD
SCHEMBL528229 0.81 MAPT (0.62) MAPTHTTKDM4ESMN1; SMN2LMNA

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