SCHEMBL9198403

SCHEMBL9198403

CCCc1c(OCCCOc2ccc(-c3cocn3)c(OC)c2CCC)ccc2c1OC(C(=O)OC)CC2

nearest known ligand 0.87

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 20/20 0.87
LTB4R2 Q9NPC1 13/20 0.87

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
SCHEMBL8990386 0.93 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL9373296 0.87 LTB4R (0.67) LTB4RLTB4R2
SCHEMBL9198565 0.87 LTB4R (0.87) LTB4RLTB4R2
SCHEMBL9192732 0.87 LTB4R (0.80) LTB4RLTB4R2
SCHEMBL9194548 0.85 LTB4R (0.87) LTB4RLTB4R2
SCHEMBL9192574 0.83 LTB4R (0.88) LTB4RLTB4R2
SCHEMBL9373836 0.83 LTB4R (0.68) LTB4RLTB4R2
SCHEMBL8877600 0.82 LTB4R (0.85) LTB4RLTB4R2
SCHEMBL9378790 0.82 LTB4R (0.68) LTB4RLTB4R2
SCHEMBL9192878 0.81 LTB4R (0.88) LTB4RLTB4R2

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-0527922-B1 ALKOXY-SUBSTITUTED DIHYDROBENZOPYRAN-2-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF SEARLE & CO (US) 1995-03-08 EP disclosed
US-5212198-A Antiinflammatory agents G. D. SEARLE & CO. (US) 1993-05-18 US disclosed
US-5192782-A Leukotriene antagonists, antiinflammatory agents G. D. SEARLE & CO. (US) 1993-03-09 US disclosed
US-5073562-A Antiinflammatory agents; leukotriene by antagonists G. D. SEARLE & CO. (US) 1991-12-17 US disclosed