SCHEMBL8944293

SCHEMBL8944293

CCCCC(=O)N(Cc1ccc(-c2ccccc2)c(-c2nc(=O)s[nH]2)c1)c1sccc1C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 18/20 0.48
AGTR1 P30556 1/20 0.39
PTGDR2 Q9Y5Y4 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
SCHEMBL8547978 0.92 LTB4R2 (0.54) LTB4R2AGTR1
SCHEMBL8944295 0.87 AGTR1 (0.38) LTB4R2AGTR1
SCHEMBL8550196 0.85 LTB4R2 (0.53) LTB4R2AGTR1
SCHEMBL8550853 0.79 LTB4R2 (0.53) LTB4R2AGTR1
SCHEMBL8547981 0.79 AGTR1 (0.42) LTB4R2AGTR1
SCHEMBL8553533 0.77 LTB4R2 (0.45) LTB4R2AGTR1
SCHEMBL8552360 0.74 LTB4R2 (0.58) LTB4R2AGTR1
SCHEMBL8944237 0.73 LTB4R2 (0.62) LTB4R2AGTR1
SCHEMBL8549173 0.71 LTB4R2 (0.53) LTB4R2AGTR1
SCHEMBL8550200 0.71 AGTR1 (0.47) LTB4R2AGTR1

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
US-5500427-A ANGIOTENSIN II ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-03-19 US disclosed