SCHEMBL8979910

SCHEMBL8979910

CCCc1nc[nH]c(=O)c1Cc1ccc(-c2ccccc2C(=O)OC)cc1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 1/20 0.46
SLC6A3 Q01959 3/20 0.46
BDKRB1 P46663 3/20 0.44
SLC6A4 P31645 2/20 0.44
LTB4R2 Q9NPC1 1/20 0.43
ACHE P22303 1/20 0.43
AGTR1 P30556 3/20 0.43
AGTR2 P50052 1/20 0.43

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
SCHEMBL8979783 0.94 AGTR1 (0.48) BRS3BDKRB1LTB4R2ACHEAGTR1
SCHEMBL8979774 0.89 BRS3 (0.48) BRS3AGTR1AGTR2
SCHEMBL8979903 0.85 BRS3 (0.47) BRS3SLC6A3BDKRB1SLC6A4LTB4R2
SCHEMBL8979750 0.83 AGTR2 (0.55) BRS3AGTR1AGTR2
SCHEMBL8979781 0.80 AGTR1 (0.48) BRS3BDKRB1LTB4R2ACHEAGTR1
SCHEMBL1888778 0.78 PPARG (0.44) BRS3ACHEAGTR1
SCHEMBL8668604 0.78 BRS3 (0.43) BRS3SLC6A3BDKRB1LTB4R2ACHE
SCHEMBL8801579 0.78 AGTR1 (0.44) BRS3SLC6A3BDKRB1SLC6A4LTB4R2
SCHEMBL8672153 0.78 LTB4R2 (0.47) BRS3SLC6A3BDKRB1SLC6A4LTB4R2
SCHEMBL8979760 0.78 AGTR1 (0.49) BRS3LTB4R2ACHEAGTR1AGTR2

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
US-5565464-A Compounds having angiotensine II antagonistic activity ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 1996-10-15 US disclosed
WO-1993003018-A1 COMPOUNDS HAVING ANGIOTENSINE II ANTAGONISTIC ACTIVITY ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 1993-02-18 WO disclosed