SCHEMBL9825015

SCHEMBL9825015

CCCn1cc(Cc2ccc(C(=O)OC)cc2OC)c2cc(N(C(C)=O)C3CCCC3)ccc21

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 7/20 0.58
CYSLTR1 Q9Y271 7/20 0.58
PLA2G4A P47712 2/20 0.42

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
SCHEMBL9825747 0.90 CYSLTR1 (0.48) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL9371999 0.80 CYSLTR2 (0.58) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL9633663 0.80 MTNR1A (0.38) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL8951488 0.80 CYSLTR2 (0.88) CYSLTR2CYSLTR1
SCHEMBL8951229 0.79 CYSLTR1 (0.72) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL8951149 0.79 CYSLTR2 (0.56) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL8114767 0.79 PLA2G4A (0.62) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL9489805 0.77 CYSLTR2 (0.53) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL9489798 0.77 CYSLTR2 (0.53) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL9527465 0.77 CYSLTR2 (0.53) CYSLTR2CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0199543-B1 HETEROCYCLIC AMIDE DERIVATIVES ICI AMERICAS INC. (US) 1991-12-04 EP disclosed
EP-0199543-A2 Heterocyclic amide derivatives ICI AMERICAS INC. (US) 1986-10-29 EP disclosed