SCHEMBL528124

SCHEMBL528124

Cc1ccc(N(Cc2ccc(NC(=O)c3ccccc3)cc2)S(=O)(=O)C(C)C)cc1C

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
MAPT P10636 7/20 0.51
LMNA P02545 5/20 0.51
MEN1 O00255 2/20 0.50
NPSR1 Q6W5P4 2/20 0.48
FKBP5 Q13451 1/20 0.48
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 2/20 0.47
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 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
SCHEMBL529757 0.92 MAPT (0.53) KMT2ANPC1RAB9AMAPTLMNA
SCHEMBL529437 0.91 MAPT (0.58) KMT2ANPC1RAB9AMAPTLMNA
SCHEMBL528370 0.90 MAPT (0.52) KMT2ANPC1RAB9AMAPTLMNA
SCHEMBL529002 0.90 LMNA (0.50) KMT2ANPC1RAB9AMAPTLMNA
SCHEMBL529226 0.89 SMN1; SMN2 (0.48) KMT2ANPC1RAB9AMAPTLMNA
SCHEMBL528931 0.89 MAPT (0.47) KMT2ANPC1RAB9AMAPTLMNA
SCHEMBL528331 0.89 FFAR1 (0.49) KMT2ANPC1RAB9AMAPTLMNA
SCHEMBL529287 0.88 KMT2A (0.64) KMT2ANPC1RAB9AMAPTLMNA
SCHEMBL528238 0.88 MAPT (0.59) KMT2ANPC1RAB9AMAPTLMNA
SCHEMBL528087 0.87 KMT2A (0.55) KMT2ANPC1RAB9AMAPTLMNA

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