SCHEMBL9512244

SCHEMBL9512244

CCCc1ccccc1OCCCOc1ccc2c(c1CCC)OC(CCC(=O)OCC)(CCC(=O)OCC)CC2=O

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 15/20 0.53
LTB4R2 Q9NPC1 15/20 0.53
PPARD Q03181 3/20 0.42
PPARG P37231 2/20 0.40
PPARA Q07869 1/20 0.37
DHFR P00374 1/20 0.37

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
SCHEMBL9515334 0.91 LTB4R (0.62) LTB4RLTB4R2PPARDPPARGPPARA
SCHEMBL9512457 0.89 LTB4R (0.43) LTB4RLTB4R2PPARDPPARGPPARA
SCHEMBL9513132 0.89 LTB4R (0.51) LTB4RLTB4R2
SCHEMBL9513714 0.89 LTB4R (0.51) LTB4RLTB4R2
SCHEMBL9515370 0.89 LTB4R (0.51) LTB4RLTB4R2
SCHEMBL9513671 0.87 LTB4R (0.41) LTB4RLTB4R2
SCHEMBL9513208 0.87 LTB4R (0.43) LTB4RLTB4R2PPARDPPARGPPARA
SCHEMBL9513652 0.86 LTB4R (0.43) LTB4RLTB4R2PPARDPPARGPPARA
SCHEMBL9514454 0.86 LTB4R (0.43) LTB4RLTB4R2PPARDPPARGPPARA
SCHEMBL9515360 0.86 LTB4R (0.43) LTB4RLTB4R2PPARDPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0342664-B1 2,2-disubstituted benzopyran leukotriene-D4 antagonists SEARLE & CO (US) 1993-12-15 EP disclosed
US-5093353-A 2,2-di-substituted benzopyran leukotriene-D4 antagonists G. D. SEARLE & CO. (US) 1992-03-03 US disclosed
EP-0342664-A2 2,2-disubstituted benzopyran leukotriene-D4 antagonists G.D. Searle & Co. (US) 1989-11-23 EP disclosed