SCHEMBL8107945

SCHEMBL8107945

c1cc(Cc2nnn[nH]2)cc(OCc2ccc3ccccc3n2)c1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 6/20 0.62
GPBAR1 Q8TDU6 2/20 0.62
CYSLTR2 Q9NS75 4/20 0.58

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
SCHEMBL10420346 0.98 CYSLTR1 (0.60) CYSLTR1GPBAR1CYSLTR2
SCHEMBL7714758 0.98 CYSLTR1 (0.60) CYSLTR1GPBAR1CYSLTR2
SCHEMBL10421737 0.97 CYSLTR1 (0.58) CYSLTR1GPBAR1CYSLTR2
SCHEMBL9829297 0.96 CYSLTR1 (0.59) CYSLTR1GPBAR1CYSLTR2
SCHEMBL7714653 0.95 CYSLTR1 (0.56) CYSLTR1GPBAR1CYSLTR2
SCHEMBL7093704 0.95 CYSLTR1 (0.56) CYSLTR1GPBAR1CYSLTR2
SCHEMBL10421806 0.94 CYSLTR1 (0.61) CYSLTR1GPBAR1CYSLTR2
SCHEMBL10420744 0.94 CYSLTR1 (0.57) CYSLTR1GPBAR1CYSLTR2
SCHEMBL9827711 0.93 CYSLTR1 (0.56) CYSLTR1GPBAR1CYSLTR2
SCHEMBL10422006 0.93 CYSLTR1 (0.58) 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
US-6121286-A ANTILEUKOTRIENE ACTIVITY AND ANTIHISTAMINIC ACTIVITY, FOR TREATING ASTHMA; COMPOUNDS SUCH AS 6-METHOXY-3-(2-(3-(2-QUINOLYLMETHOXY)BENZYL)TETRAZOLYL)QUINOLIN-2-ONE KOWA CO., LTD. (JP) 2000-09-19 US disclosed
US-6117886-A EXCELLENT ANTILEUKOTRIENE ACTIVITY AND ANTIHISTAMINIC ACTIVITY, AND IS USEFUL FOR THE PREVENTION AND TREATMENT OF, FOR EXAMPLE, ASTHMA. KOWA CO., LTD. (JP) 2000-09-12 US disclosed