SCHEMBL9864623

SCHEMBL9864623

CCCCCCCCCCCCc1ccccc1[C@H](SCCC(=O)O)C(=O)O

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 18/20 0.77
CYSLTR1 Q9Y271 18/20 0.77

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
SCHEMBL9158808 1.00 CYSLTR2 (0.77) CYSLTR2CYSLTR1
SCHEMBL9560029 1.00 CYSLTR2 (0.77) CYSLTR2CYSLTR1
SCHEMBL9559806 0.94 CYSLTR2 (0.78) CYSLTR2CYSLTR1
SCHEMBL9560024 0.89 CYSLTR2 (0.77) CYSLTR2CYSLTR1
SCHEMBL9160570 0.89 CYSLTR2 (0.77) CYSLTR2CYSLTR1
SCHEMBL9864015 0.89 CYSLTR2 (0.77) CYSLTR2CYSLTR1
SCHEMBL9560196 0.88 CYSLTR2 (0.61) CYSLTR2CYSLTR1
SCHEMBL9560134 0.88 CYSLTR2 (0.60) CYSLTR2CYSLTR1
SCHEMBL10482280 0.87 CYSLTR2 (0.69) CYSLTR2CYSLTR1
SCHEMBL9560087 0.87 CYSLTR2 (0.76) 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-5034537-A Alpha-methyl-4-halobenzenemethanamine salts of acids for cardiovascular disorders, respiratory system disorders and antiallergens SMITHKLINE BEECHAM CORPORATION (US) 1991-07-23 US claimed