SCHEMBL9818449

SCHEMBL9818449

COc1cc(OCc2ccc3ccccc3n2)ccc1OCc1cccc(-c2nnn[nH]2)c1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.49
CYSLTR1 Q9Y271 1/20 0.49

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
SCHEMBL6088675 0.93 CYSLTR1 (0.50) CYSLTR2CYSLTR1
SCHEMBL9818404 0.90 CYSLTR1 (0.54) CYSLTR2CYSLTR1
SCHEMBL6090364 0.90 CYSLTR1 (0.50) CYSLTR2CYSLTR1
SCHEMBL6089637 0.89 CYSLTR1 (0.47) CYSLTR2CYSLTR1
SCHEMBL6088514 0.89 CYSLTR1 (0.53) CYSLTR2CYSLTR1
SCHEMBL9818473 0.89 CYSLTR1 (0.47) CYSLTR2CYSLTR1
SCHEMBL7008709 0.88 CYSLTR1 (0.57) CYSLTR2CYSLTR1
SCHEMBL10536269 0.86 CYSLTR2 (0.42) CYSLTR2CYSLTR1
SCHEMBL7010321 0.86 CYSLTR1 (0.60) CYSLTR2CYSLTR1
SCHEMBL9818450 0.86 CYSLTR1 (0.52) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5059610-A QUINOLINE DERIVATIVES AND THEIR USE AS ANTAGONISTS OF LEUKOTRIENE D4 RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-10-22 US disclosed