SCHEMBL8735648

SCHEMBL8735648

OCc1ccc2ccc(OCc3ccc4ccccc4n3)cc2c1

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 10/20 0.78
GPBAR1 Q8TDU6 4/20 0.76
PDE10A Q9Y233 1/20 0.61
CYSLTR2 Q9NS75 2/20 0.58
FFAR1 O14842 1/20 0.57
AKR1B1 P15121 1/20 0.57

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
SCHEMBL3076102 0.88 CYSLTR1 (1.00) CYSLTR1GPBAR1PDE10ACYSLTR2FFAR1
SCHEMBL10512475 0.87 PDE10A (0.77) CYSLTR1GPBAR1PDE10ACYSLTR2
SCHEMBL4848317 0.86 CYSLTR1 (1.00) CYSLTR1GPBAR1PDE10ACYSLTR2
SCHEMBL30443879 0.86 CYSLTR1 (1.00) CYSLTR1GPBAR1PDE10ACYSLTR2
SCHEMBL8734106 0.85 PDE10A (0.66) CYSLTR1GPBAR1PDE10ACYSLTR2
SCHEMBL7007747 0.84 CYSLTR1 (0.95) CYSLTR1GPBAR1CYSLTR2
SCHEMBL7801881 0.84 CYSLTR1 (0.64) CYSLTR1GPBAR1PDE10ACYSLTR2FFAR1
SCHEMBL26771259 0.84 CYSLTR1 (0.92) CYSLTR1GPBAR1PDE10ACYSLTR2FFAR1
SCHEMBL9828870 0.84 CYSLTR1 (0.76) CYSLTR1GPBAR1PDE10ACYSLTR2FFAR1
SCHEMBL26771316 0.83 CYSLTR1 (0.82) CYSLTR1GPBAR1CYSLTR2

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-0874826-A1 NAPHTHALENE QUINOLINES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1998-11-04 EP disclosed
WO-1997024331-A1 NAPHTHALENE QUINOLINES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1997-07-10 WO disclosed