SCHEMBL8979746

SCHEMBL8979746

CCCCC(=O)C(Cc1ccc(-c2ccccc2C(=O)OC)cc1)C(=O)COC

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 6/20 0.55
BDKRB1 P46663 5/20 0.51
SLC6A3 Q01959 4/20 0.46
SLC6A4 P31645 3/20 0.46
AGTR1 P30556 2/20 0.45
AGTR2 P50052 1/20 0.45
ACHE P22303 1/20 0.43
SLC6A2 P23975 1/20 0.42
BRS3 P32247 1/20 0.42

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
SCHEMBL9153918 0.90 LTB4R2 (0.45) LTB4R2BDKRB1AGTR1AGTR2ACHE
SCHEMBL8671881 0.89 LTB4R2 (0.57) LTB4R2BDKRB1SLC6A3SLC6A4AGTR1
SCHEMBL8979799 0.89 LTB4R2 (0.53) LTB4R2BDKRB1SLC6A3SLC6A4AGTR1
SCHEMBL9280307 0.88 LTB4R2 (0.46) LTB4R2BDKRB1AGTR1AGTR2
SCHEMBL8979895 0.87 LTB4R2 (0.49) LTB4R2BDKRB1SLC6A3SLC6A4AGTR1
SCHEMBL8979749 0.82 LTB4R2 (0.48) LTB4R2BDKRB1SLC6A3SLC6A4AGTR1
SCHEMBL8670621 0.82 LTB4R2 (0.51) LTB4R2BDKRB1SLC6A3SLC6A4AGTR1
SCHEMBL9024939 0.81 LTB4R2 (0.58) LTB4R2AGTR1BRS3
SCHEMBL8673632 0.81 LTB4R2 (0.48) LTB4R2BDKRB1SLC6A3SLC6A4AGTR1
SCHEMBL9154927 0.79 ACHE (0.43) LTB4R2BDKRB1AGTR1ACHEBRS3

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