SCHEMBL8990523

SCHEMBL8990523

CCCc1c(OCCCOc2ccc(-c3c[nH]c(SCc4ccccc4)n3)c(OC)c2CCC)ccc2c1OC(C(=O)O)CC2

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 20/20 0.77
LTB4R2 Q9NPC1 12/20 0.66

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
SCHEMBL9198731 0.95 LTB4R (0.71) LTB4RLTB4R2
SCHEMBL9199443 0.91 LTB4R (0.64) LTB4RLTB4R2
SCHEMBL9527216 0.89 LTB4R (0.64) LTB4RLTB4R2
SCHEMBL8990426 0.87 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL9527226 0.83 LTB4R (0.59) LTB4RLTB4R2
SCHEMBL8990542 0.83 LTB4R (0.78) LTB4RLTB4R2
SCHEMBL9372980 0.81 LTB4R (0.80) LTB4RLTB4R2
SCHEMBL8990396 0.80 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL8990386 0.80 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL9373456 0.80 LTB4R (0.77) 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 12 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 claimed
US-5212198-A Antiinflammatory agents G. D. SEARLE & CO. (US) 1993-05-18 US claimed
EP-0527922-A1 ALKOXY-SUBSTITUTED DIHYDROBENZOPYRAN-2-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF. SEARLE & CO (US) 1993-02-24 EP claimed
WO-1991017160-A1 ALKOXY-SUBSTITUTED DIHYDROBENZOPYRAN-2-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF G.D. SEARLE & CO. (US) 1991-11-14 WO claimed
US-5578619-A LEUKOTRIENE B4 ANTAGONISTS, ANTIINFLAMMATORY AGENTS SEARLE & CO (US) 1996-11-26 US disclosed
WO-1995032201-A1 ALKOXY-SUBSTITUTED DIHYDROBENZOPYRAN-2-SULFONIMIDES DERIVATIVES, THEIR PREPARATION AND THEIR USE AS LEUKOTRIENE B4 ANTAGONISTS G.D. SEARLE & CO. (US) 1995-11-30 WO disclosed
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
EP-0527922-A1 ALKOXY-SUBSTITUTED DIHYDROBENZOPYRAN-2-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF. SEARLE & CO (US) 1993-02-24 EP disclosed
US-5073562-A Antiinflammatory agents; leukotriene by antagonists G. D. SEARLE & CO. (US) 1991-12-17 US disclosed
WO-1991017160-A1 ALKOXY-SUBSTITUTED DIHYDROBENZOPYRAN-2-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF G.D. SEARLE & CO. (US) 1991-11-14 WO disclosed