SCHEMBL528274

SCHEMBL528274

COc1ccccc1C(=O)Nc1ccc(CN(c2ccc(C)c(C)c2)S(=O)(=O)C2CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
THRB P10828 1/20 0.46
MAPT P10636 7/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
RAB9A P51151 5/20 0.45
ALDH1A1 P00352 4/20 0.45
TP53 P04637 2/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
POLB P06746 2/20 0.44
KCNK3 O14649 2/20 0.44
KCNK9 Q9NPC2 2/20 0.44
HTT P42858 1/20 0.44
MAPK1 P28482 3/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 2/20 0.44
AHR P35869 1/20 0.44
GFER P55789 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
SCHEMBL528572 0.91 RXFP1 (0.48) MAPTKMT2AMEN1RAB9AALDH1A1
SCHEMBL528272 0.90 MAPT (0.45) L3MBTL1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL528053 0.89 MAPT (0.55) MAPTSMN1; SMN2KMT2AMEN1RAB9A
SCHEMBL529438 0.88 MAPT (0.54) MAPTSMN1; SMN2KMT2AMEN1RAB9A
SCHEMBL528468 0.88 L3MBTL1 (0.57) L3MBTL1THRBMAPTSMN1; SMN2KMT2A
SCHEMBL528514 0.87 L3MBTL1 (0.49) L3MBTL1THRBMAPTSMN1; SMN2KMT2A
SCHEMBL529284 0.85 ALDH1A1 (0.56) L3MBTL1THRBMAPTSMN1; SMN2KMT2A
SCHEMBL528660 0.85 L3MBTL1 (0.48) L3MBTL1THRBMAPTSMN1; SMN2KMT2A
SCHEMBL529288 0.84 MAPT (0.58) MAPTSMN1; SMN2ALDH1A1TP53HPGD
SCHEMBL529461 0.83 MAPT (0.50) THRBMAPTSMN1; SMN2KMT2AMEN1

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