SCHEMBL7808312

SCHEMBL7808312

N#Cc1ccc2cc(OCc3ccc4ccccc4n3)ccc2c1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 9/20 0.64
CYSLTR2 Q9NS75 4/20 0.64
PDE10A Q9Y233 3/20 0.63
GPBAR1 Q8TDU6 7/20 0.57
FFAR1 O14842 1/20 0.52
AKR1B1 P15121 1/20 0.52
CYP1A2 P05177 1/20 0.52

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
SCHEMBL10607508 0.92 CYSLTR1 (0.71) CYSLTR1CYSLTR2PDE10AGPBAR1FFAR1
SCHEMBL10545699 0.89 CYSLTR1 (0.68) CYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL9031944 0.87 CYSLTR1 (0.66) CYSLTR1CYSLTR2PDE10AGPBAR1FFAR1
SCHEMBL9031363 0.87 CYSLTR1 (0.66) CYSLTR1CYSLTR2PDE10AGPBAR1FFAR1
SCHEMBL10512475 0.85 PDE10A (0.77) CYSLTR1CYSLTR2PDE10AGPBAR1CYP1A2
SCHEMBL9828564 0.85 CYSLTR1 (0.65) CYSLTR1CYSLTR2PDE10AGPBAR1FFAR1
SCHEMBL7007566 0.85 CYSLTR1 (0.62) CYSLTR1CYSLTR2GPBAR1
SCHEMBL7005048 0.84 CYSLTR1 (0.66) CYSLTR1CYSLTR2GPBAR1
SCHEMBL1423457 0.83 CYSLTR1 (0.62) CYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL9828521 0.83 CYSLTR1 (0.58) CYSLTR1CYSLTR2PDE10AGPBAR1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0775133-B1 NAPHTHALENE AMIDES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION MENARINI LAB (ES) 2001-05-30 EP disclosed
EP-0775133-A1 NAPHTHALENE AMIDES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1997-05-28 EP disclosed
WO-1996004267-A1 NAPHTHALENE AMIDES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1996-02-15 WO disclosed