SCHEMBL9480359

SCHEMBL9480359

CCCCc1cc(COC)nn1Cc1ccc2c(-c3ccccc3C(=O)O)oc(Br)c2c1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 1/20 0.44
AGTR1 P30556 7/20 0.40
AGTR2 P50052 6/20 0.40

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
SCHEMBL9480354 0.90 AGTR1 (0.47) PTGER1AGTR1AGTR2
SCHEMBL9492039 0.88 PTGER1 (0.42) PTGER1AGTR1AGTR2
SCHEMBL9492035 0.83 AGTR1 (0.43) PTGER1AGTR1AGTR2
SCHEMBL9480600 0.82 AGTR1 (0.34) PTGER1AGTR1
SCHEMBL7049483 0.82 AGTR1 (0.58) AGTR1AGTR2
SCHEMBL9481020 0.80 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9492042 0.80 PTGER1 (0.40) PTGER1AGTR1AGTR2
SCHEMBL9309709 0.77 AGTR1 (0.65) AGTR1AGTR2
SCHEMBL9427972 0.76 PPARG (0.57) AGTR1AGTR2
SCHEMBL9481790 0.75 AGTR1 (0.39) AGTR1AGTR2

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-0559724-A1 BENZOFURAN AND BENZTHIOPHENE DERIVATIVES GLAXO GROUP LIMITED (GB) 1993-09-15 EP disclosed
WO-1992009600-A1 BENZOFURAN AND BENZTHIOPHENE DERIVATIVES GLAXO GROUP LIMITED (GB) 1992-06-11 WO disclosed