SCHEMBL9636892

SCHEMBL9636892

NC(=O)Cc1cc(=O)c2ccc(COc3ccc(OCc4ccc5ccccc5n4)cc3)cc2o1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 8/20 0.51
ALOX5 P09917 3/20 0.50
FFAR1 O14842 1/20 0.49
AKR1B1 P15121 1/20 0.49
GPBAR1 Q8TDU6 1/20 0.47
CYSLTR2 Q9NS75 2/20 0.47

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
SCHEMBL9635515 0.89 CYSLTR1 (0.51) CYSLTR1ALOX5FFAR1AKR1B1GPBAR1
SCHEMBL9635547 0.87 CYSLTR1 (0.65) CYSLTR1FFAR1AKR1B1GPBAR1CYSLTR2
SCHEMBL9635460 0.84 CYSLTR1 (0.47) CYSLTR1ALOX5FFAR1AKR1B1GPBAR1
SCHEMBL9635502 0.83 AKR1B1 (0.53) CYSLTR1ALOX5FFAR1AKR1B1GPBAR1
SCHEMBL9674022 0.83 CYSLTR1 (0.45) CYSLTR1ALOX5FFAR1AKR1B1CYSLTR2
SCHEMBL9635521 0.82 CYSLTR1 (0.44) CYSLTR1ALOX5
SCHEMBL9757069 0.81 ALOX5 (0.53) CYSLTR1ALOX5FFAR1AKR1B1GPBAR1
SCHEMBL18397781 0.81 PDE10A (0.51) CYSLTR1ALOX5GPBAR1CYSLTR2
SCHEMBL9636980 0.80 CYSLTR1 (0.50) CYSLTR1CYSLTR2
Hydrochloric Acid SCHEMBL18397903 0.80 LOXL2 (0.52) CYSLTR1ALOX5GPBAR1CYSLTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5082849-A Antiinflammatory agents or antiallergens AVENTIS PHARMACEUTICALS INC. 1992-01-21 US disclosed
EP-0434827-A4 QUINOLINYL-BENZOPYRAN DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D 4? 1992-01-08 EP disclosed
EP-0434827-A1 QUINOLINYL-BENZOPYRAN DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D 4? RORER INTERNATIONAL (HOLDINGS), INC. (US) 1991-07-03 EP disclosed
WO-1991001123-A2 QUINOLINYL-BENZOPYRAN DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D¿4? RORER INTERNATIONAL (OVERSEAS) INC. (US) 1991-02-07 WO disclosed
US-4977162-A Quinolinyl-chromone derivatives and use for treatment of hypersensitive ailments RORER PHARMACEUTICAL CORPORATION (US) 1990-12-11 US disclosed