SCHEMBL11289132

SCHEMBL11289132

Nc1c(Cl)cc(C(=O)Cc2ccccc2)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
HSD11B1 P28845 3/20 0.51
PLAU P00749 2/20 0.49
SRD5A2 P31213 2/20 0.49
RAB9A P51151 2/20 0.47
GAA P10253 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
STS P08842 1/20 0.45
SMO Q99835 1/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
AKR1B1 P15121 1/20 0.44
GRM1 Q13255 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
SCHEMBL11289129 0.86 MAPT (0.54) MAPTL3MBTL1HSD11B1PLAUSRD5A2
SCHEMBL1515720 0.81 MAPT (0.66) MAPTL3MBTL1HSD11B1PLAUSRD5A2
SCHEMBL1515715 0.80 L3MBTL1 (0.70) MAPTL3MBTL1PLAUSRD5A2RAB9A
SCHEMBL13577050 0.80 MAPT (0.60) MAPTL3MBTL1PLAUSRD5A2RAB9A
SCHEMBL15100944 0.77 MAPT (0.60) MAPTL3MBTL1HSD11B1PLAUSRD5A2
SCHEMBL256731 0.77 MAPT (0.60) MAPTL3MBTL1HSD11B1PLAUSRD5A2
SCHEMBL1515818 0.77 L3MBTL1 (0.65) MAPTL3MBTL1PLAUSRD5A2RAB9A
SCHEMBL11251033 0.75 MAPT (0.50) MAPTL3MBTL1RAB9AMEN1KMT2A
SCHEMBL7129800 0.75 MAPT (0.80) MAPTL3MBTL1PLAUSRD5A2RAB9A
SCHEMBL24800 0.75 MAPT (0.73) MAPTL3MBTL1PLAUSRD5A2RAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0006298-B1 ANTI-INFLAMMATORY 1-PHENYL-2-AMINOETHANOL DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF FOR TOPICAL USE, AND PROCESSES FOR THEIR MANUFACTURE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-03-31 EP disclosed
US-4303649-A ANTIINFLAMMATORY AGENTS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-12-01 US disclosed
EP-0006298-A1 Anti-inflammatory 1-phenyl-2-aminoethanol derivatives, pharmaceutical compositions thereof for topical use, and processes for their manufacture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-01-09 EP disclosed