SCHEMBL9526476

SCHEMBL9526476

CCCc1c(OCCCOc2ccc3c(c2CCC)OC(C(=O)OC)CC3)ccc(CC(=O)O)c1OC

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 20/20 0.66
LTB4R2 Q9NPC1 11/20 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
SCHEMBL9525570 0.92 LTB4R (0.63) LTB4RLTB4R2
SCHEMBL9526112 0.88 LTB4R (0.65) LTB4RLTB4R2
SCHEMBL9526445 0.87 LTB4R (0.60) LTB4RLTB4R2
SCHEMBL8877600 0.86 LTB4R (0.85) LTB4RLTB4R2
SCHEMBL9821750 0.85 LTB4R (0.72) LTB4RLTB4R2
SCHEMBL9192583 0.84 LTB4R (0.71) LTB4RLTB4R2
SCHEMBL8957165 0.84 LTB4R (0.87) LTB4RLTB4R2
SCHEMBL9198541 0.84 LTB4R (0.70) LTB4RLTB4R2
SCHEMBL9821823 0.83 LTB4R (0.81) LTB4RLTB4R2
SCHEMBL9821777 0.83 LTB4R (0.62) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0527922-A1 ALKOXY-SUBSTITUTED DIHYDROBENZOPYRAN-2-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF. SEARLE & CO (US) 1993-02-24 EP disclosed
WO-1991017160-A1 ALKOXY-SUBSTITUTED DIHYDROBENZOPYRAN-2-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF G.D. SEARLE & CO. (US) 1991-11-14 WO disclosed