SCHEMBL8764977

SCHEMBL8764977

[O]c1ccccc1OCCCCCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.53
CYSLTR1 Q9Y271 1/20 0.53
FFAR1 O14842 1/20 0.47
MAOA P21397 1/20 0.47
MAPT P10636 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
PLA2G4B P0C869 1/20 0.46
NAAA Q02083 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
IDO1 P14902 1/20 0.44
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
S1PR1 P21453 2/20 0.43
S1PR3 Q99500 1/20 0.43
S1PR5 Q9H228 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
SCHEMBL8764941 0.87 CYP11B1 (0.49) FFAR1MAOAIDO1
SCHEMBL11262209 0.80 HTR1A (0.58) MAPTL3MBTL1
SCHEMBL6000358 0.79 ALDH1A1 (0.65) CYSLTR2CYSLTR1FFAR1MAPTPLA2G4B
SCHEMBL9428004 0.79 ALDH1A1 (0.65) CYSLTR2CYSLTR1FFAR1MAPTPLA2G4B
SCHEMBL28256649 0.79 PDE4A (0.50) CYSLTR2CYSLTR1FFAR1MAPTRXFP1
SCHEMBL1836648 0.79 JAK2 (0.60) CYSLTR2CYSLTR1FFAR1MAPT
SCHEMBL5547710 0.79 CYSLTR2 (0.47) CYSLTR2CYSLTR1FFAR1MAOAPLA2G4B
SCHEMBL9804792 0.79 CYSLTR2 (0.50) CYSLTR2CYSLTR1FFAR1MAPTRXFP1
SCHEMBL1838169 0.79 JAK2 (0.60) CYSLTR2CYSLTR1FFAR1MAPT
SCHEMBL1836365 0.79 JAK2 (0.60) CYSLTR2CYSLTR1FFAR1MAPT

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
EP-0778267-A1 SULFONAMIDE DERIVATIVES AND INSECTICIDE, MITICIDE AND NEMATICIDE CONTAINING THE SAME OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1997-06-11 EP disclosed