SCHEMBL9491087

SCHEMBL9491087

COC(=O)c1ccc(Cc2c(Cl)n(C)c3ccc(CC(C)NC(=O)N(C)C)cc23)c(OC)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 4/20 0.35
LTB4R Q15722 1/20 0.35
PPARG P37231 1/20 0.35
ACACB O00763 3/20 0.35
TP53 P04637 1/20 0.34
GLA P06280 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 2/20 0.33
ADRB2 P07550 1/20 0.33
PTGS2 P35354 2/20 0.33

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
SCHEMBL9488306 0.93 PLA2G4A (0.42) PLA2G4ALTB4R
SCHEMBL9489871 0.89 GLA (0.34) PLA2G4ALTB4RPPARGTP53GLA
SCHEMBL9490124 0.85 MAPT (0.39) TP53GLAKMT2AMAPT
SCHEMBL9491493 0.85 CYSLTR2 (0.49)
SCHEMBL9489982 0.84
SCHEMBL9488885 0.84 PLA2G4A (0.43) PLA2G4A
SCHEMBL9489923 0.82 PLA2G4A (0.40) PLA2G4ALTB4R
SCHEMBL9490186 0.78 PLA2G4A (0.41) PLA2G4ALTB4RMAPT
SCHEMBL9488342 0.77 PLA2G4A (0.51) PLA2G4ALTB4R
SCHEMBL9488872 0.77 MAPT (0.39) TP53GLAKMT2AMAPT

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-0337766-B1 HETERA-ALIPHATIC CARBOXAMIDES ICI AMERICAS INC. (US) 1993-03-10 EP disclosed
US-5041460-A Antiallergens, antiinflammatory agents and leukotriene antagonists ICI AMERICAS INC. (US) 1991-08-20 US disclosed
EP-0337766-A1 Hetera-aliphatic carboxamides ICI AMERICAS INC. (US) 1989-10-18 EP disclosed