SCHEMBL529002

SCHEMBL529002

Cc1ccc(N(Cc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)S(=O)(=O)C(C)C)cc1C

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
ALDH1A1 P00352 6/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
HTT P42858 2/20 0.48
HPGD P15428 2/20 0.48
MAPT P10636 7/20 0.46
NPSR1 Q6W5P4 2/20 0.45
HSD17B10 Q99714 1/20 0.45
KDM4E B2RXH2 2/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA9 Q16790 1/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
EGFR P00533 1/20 0.43
ERBB2 P04626 1/20 0.43
CNR1 P21554 1/20 0.43

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) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL528370 0.90 MAPT (0.52) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL528124 0.90 KMT2A (0.53) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL528931 0.89 MAPT (0.47) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL528323 0.89 GAA (0.44) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL528307 0.89 KMT2A (0.63) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL528511 0.88 KMT2A (0.52) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL528374 0.87 SMN1; SMN2 (0.45) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL527888 0.87 MAPT (0.45) LMNAALDH1A1SMN1; SMN2HTTHPGD
SCHEMBL528858 0.86 ROCK2 (0.51) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2

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