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SCHEMBL13495677

SCHEMBL13495677

CCCCC(=O)N(Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1)C(C)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 13/20 0.61
▸ LTB4R2 Q9NPC1 7/20 0.51
▸ ABCB11 O95342 1/20 0.51
▸ GP6 Q9HCN6 1/20 0.51
▸ AGTR2 P50052 1/20 0.45
▸ AGT P01019 2/20 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
SCHEMBL2828658 0.92 AGTR1 (0.62) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL28455049 0.92 AGTR1 (0.62) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL1891052 0.92 AGTR1 (0.62) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL8140438 0.88 AGTR1 (0.56) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL5591584 0.88 AGTR1 (0.53) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL1259493 0.87 AGTR1 (0.63) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL29670077 0.87 AGTR1 (0.63) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL2443650 0.87 AGTR1 (0.63) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL9490068 0.87 LTB4R2 (0.46) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL4796582 0.86 AGTR1 (0.48) AGTR1LTB4R2ABCB11GP6AGTR2

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
WO-2010015447-A1 ANGIOTENSIN II RECEPTOR ANTAGONISTS NICOX S.A. (FR) 2010-02-11 — — WO disclosed
WO-2009150007-A1 ANGIOTENSIN II RECEPTOR ANTAGONISTS NICOX S.A. (FR) 2009-12-17 — — WO disclosed