SCHEMBL8192801

SCHEMBL8192801

O=C(C=Cc1ccc(OCc2ccc3ccccc3n2)cc1)c1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR1 Q9Y271 18/20 0.78
▸ CYSLTR2 Q9NS75 17/20 0.78
▸ GPBAR1 Q8TDU6 2/20 0.66
▸ PDE10A Q9Y233 1/20 0.59

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
SCHEMBL6965141 0.88 CYSLTR2 (1.00) CYSLTR1CYSLTR2GPBAR1
SCHEMBL6965145 0.88 CYSLTR2 (1.00) CYSLTR1CYSLTR2GPBAR1
SCHEMBL30383176 0.88 CYSLTR2 (1.00) CYSLTR1CYSLTR2GPBAR1
SCHEMBL6954787 0.87 CYSLTR1 (0.74) CYSLTR1CYSLTR2GPBAR1
SCHEMBL6954791 0.87 CYSLTR1 (0.74) CYSLTR1CYSLTR2GPBAR1
SCHEMBL9033055 0.86 GPBAR1 (0.85) CYSLTR1CYSLTR2GPBAR1PDE10A
SCHEMBL9033119 0.86 GPBAR1 (0.85) CYSLTR1CYSLTR2GPBAR1PDE10A
SCHEMBL6176975 0.85 CYSLTR2 (1.00) CYSLTR1CYSLTR2GPBAR1
SCHEMBL6177481 0.85 CYSLTR2 (1.00) CYSLTR1CYSLTR2GPBAR1
SCHEMBL6968142 0.85 CYSLTR2 (1.00) CYSLTR1CYSLTR2GPBAR1

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-6046212-A ANTIALLERGIC AGENTS KOWA CO., LTD. (JP) 2000-04-04 — — US disclosed
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