SCHEMBL9203644

SCHEMBL9203644

COC(=O)CC(=O)c1cccc(OCc2ccc3ccc(Cl)cc3n2)c1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR1 Q9Y271 3/20 0.60
▸ GPBAR1 Q8TDU6 1/20 0.56
▸ CYSLTR2 Q9NS75 1/20 0.55
▸ NR4A2 P43354 2/20 0.46
▸ NR4A1 P22736 1/20 0.46
▸ NR4A3 Q92570 1/20 0.46

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
SCHEMBL9207687 0.86 CYSLTR1 (0.59) CYSLTR1GPBAR1CYSLTR2NR4A2NR4A1
SCHEMBL9206569 0.85 MAOB (0.62) CYSLTR1GPBAR1CYSLTR2NR4A2NR4A1
SCHEMBL9201308 0.85 CYSLTR1 (0.55) CYSLTR1GPBAR1CYSLTR2NR4A2
SCHEMBL9207699 0.82 PLA2G2A (0.47) CYSLTR1CYSLTR2
SCHEMBL10638941 0.80 CYSLTR1 (0.74) CYSLTR1GPBAR1CYSLTR2
SCHEMBL9205351 0.79 CYSLTR1 (0.63) CYSLTR1GPBAR1CYSLTR2
SCHEMBL10632363 0.78 CYSLTR1 (0.71) CYSLTR1GPBAR1CYSLTR2
SCHEMBL10638668 0.78 CYSLTR1 (0.71) CYSLTR1GPBAR1CYSLTR2
SCHEMBL9054057 0.78 NPC1 (0.55) CYSLTR1GPBAR1CYSLTR2
SCHEMBL9259437 0.77 CYSLTR2 (0.51) CYSLTR1CYSLTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0399818-B1 Diarylstyrylquinoline diacids MERCK FROSST CANADA INC (CA) 1995-08-16 — — EP disclosed
US-5204358-A Antiallergens; antiinflammatory agents; treatment of asthma, rhinitis, bronchitis and skin diseases MERCK FROSST CANADA, INC. (CA) 1993-04-20 — — US disclosed
US-5104882-A Leukotriene antagonists MERCK FROSST CANADA, INC. (CA) 1992-04-14 — — US disclosed
EP-0399818-A1 Diarylstyrylquinoline diacids MERCK FROSST CANADA INC. (CA) 1990-11-28 — — EP disclosed
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