SCHEMBL9529693

SCHEMBL9529693

CCCc1c(OCCCOc2ccc(C=CC(=O)N(C)C)c(OC)c2CC2CC2)ccc2c1OC(C(=O)O)CC2

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 20/20 0.68
LTB4R2 Q9NPC1 10/20 0.63

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
SCHEMBL9528142 0.95 LTB4R (0.73) LTB4RLTB4R2
SCHEMBL9530388 0.93 LTB4R (0.60) LTB4RLTB4R2
SCHEMBL9528105 0.92 LTB4R (0.66) LTB4RLTB4R2
SCHEMBL9528778 0.85 LTB4R (0.57) LTB4RLTB4R2
SCHEMBL9377488 0.84 LTB4R (0.74) LTB4RLTB4R2
SCHEMBL9377497 0.84 LTB4R (0.74) LTB4RLTB4R2
SCHEMBL5694802 0.83 LTB4R (0.90) LTB4RLTB4R2
SCHEMBL8941423 0.82 LTB4R (0.90) LTB4RLTB4R2
SCHEMBL8941563 0.81 LTB4R (1.00) LTB4RLTB4R2
SCHEMBL9378602 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0528935-A1 ALKOXY-SUBSTITUTED DIHYDROBENZOPYRAN-2-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF. SEARLE & CO (US) 1993-03-03 EP disclosed