SCHEMBL8979783

SCHEMBL8979783

CCCCc1nc[nH]c(=O)c1Cc1ccc(-c2ccccc2C(=O)OC)cc1

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.48
ACHE P22303 1/20 0.48
AGTR2 P50052 1/20 0.48
LTB4R2 Q9NPC1 1/20 0.46
BDKRB1 P46663 1/20 0.45
BRS3 P32247 1/20 0.45

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
SCHEMBL8979910 0.94 BRS3 (0.46) AGTR1ACHEAGTR2LTB4R2BDKRB1
SCHEMBL8979750 0.89 AGTR2 (0.55) AGTR1AGTR2BRS3
SCHEMBL8979781 0.85 AGTR1 (0.48) AGTR1ACHEAGTR2LTB4R2BDKRB1
SCHEMBL8979760 0.84 AGTR1 (0.49) AGTR1ACHEAGTR2LTB4R2BRS3
SCHEMBL8979880 0.84 AGTR1 (0.49) AGTR1ACHEAGTR2LTB4R2BRS3
SCHEMBL8672211 0.83 AGTR1 (0.49) AGTR1ACHEAGTR2LTB4R2BRS3
SCHEMBL8979774 0.83 BRS3 (0.48) AGTR1AGTR2BRS3
SCHEMBL8979814 0.82 AGTR1 (0.48) AGTR1ACHEAGTR2LTB4R2BRS3
SCHEMBL8801579 0.82 AGTR1 (0.44) AGTR1ACHEAGTR2LTB4R2BDKRB1
SCHEMBL8979903 0.81 BRS3 (0.47) AGTR1ACHEAGTR2LTB4R2BDKRB1

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 3 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
EP-0641329-A1 COMPOUNDS HAVING ANGIOTENSINE II ANTAGONISTIC ACTIVITY ISTITUTO LUSO FARMACO D'ITALIA S.p.A. (IT) 1995-03-08 EP disclosed
WO-1993003018-A1 COMPOUNDS HAVING ANGIOTENSINE II ANTAGONISTIC ACTIVITY ISTITUTO LUSO FARMACO D'ITALIA S.P.A. (IT) 1993-02-18 WO disclosed