SCHEMBL9828138

SCHEMBL9828138

c1ccc2nc(COc3ccc(CCc4ccc(-c5nnn[nH]5)cc4)cc3)ccc2c1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 10/20 0.63
CYSLTR2 Q9NS75 9/20 0.63
FFAR1 O14842 1/20 0.56
AKR1B1 P15121 1/20 0.56

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
SCHEMBL9830499 0.96 CYSLTR1 (0.64) CYSLTR1CYSLTR2FFAR1AKR1B1
SCHEMBL9828218 0.96 CYSLTR1 (0.61) CYSLTR1CYSLTR2FFAR1AKR1B1
SCHEMBL7715802 0.94 CYSLTR1 (0.57) CYSLTR1CYSLTR2FFAR1AKR1B1
SCHEMBL7101389 0.94 CYSLTR1 (0.57) CYSLTR1CYSLTR2FFAR1AKR1B1
SCHEMBL12892171 0.94 CYSLTR1 (0.59) CYSLTR1CYSLTR2
SCHEMBL9827649 0.93 CYSLTR1 (0.61) CYSLTR1CYSLTR2FFAR1AKR1B1
SCHEMBL9829921 0.91 CYSLTR1 (0.58) CYSLTR1CYSLTR2
SCHEMBL9828161 0.91 CYSLTR1 (0.58) CYSLTR1CYSLTR2FFAR1AKR1B1
SCHEMBL8734229 0.88 CYSLTR1 (0.60) CYSLTR1CYSLTR2
SCHEMBL9030379 0.88 CYSLTR1 (0.52) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5051427-A Antiinflammatory agents and antiallergens RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-09-24 US claimed
EP-0395697-A4 QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D 4? 1991-03-13 EP claimed
EP-0395697-A1 QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D 4 RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1990-11-07 EP claimed
US-4920133-A Quinoline derivatives and use thereof as antagonists of leukotriene D4 RORER PHARMACEUTICAL CORP. (US) 1990-04-24 US claimed
WO-1989004303-A1 QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D4 RORER INTERNATIONAL (OVERSEAS) INC. (US) 1989-05-18 WO claimed
US-5051427-A Antiinflammatory agents and antiallergens RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-09-24 US disclosed
EP-0395697-A4 QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D 4? 1991-03-13 EP disclosed
EP-0395697-A1 QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D 4 RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1990-11-07 EP disclosed
US-4920133-A Quinoline derivatives and use thereof as antagonists of leukotriene D4 RORER PHARMACEUTICAL CORP. (US) 1990-04-24 US disclosed
WO-1989004303-A1 QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D4 RORER INTERNATIONAL (OVERSEAS) INC. (US) 1989-05-18 WO disclosed