SCHEMBL21065255

SCHEMBL21065255

CC(C)(C)OC(=O)N(Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1)c1c(N)cccc1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.39
AGTR2 P50052 2/20 0.39
LTB4R2 Q9NPC1 15/20 0.38
AGT P01019 1/20 0.36

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
SCHEMBL16824592 0.88 AGTR1 (0.37) AGTR1AGTR2LTB4R2AGT
SCHEMBL16824593 0.84 AGTR1 (0.42) AGTR1AGTR2AGT
SCHEMBL21065260 0.82 LTB4R2 (0.38) AGTR1AGTR2LTB4R2AGT
SCHEMBL16824598 0.81 AGT (0.39) AGTR1AGTR2LTB4R2AGT
SCHEMBL21065276 0.80 AGTR1 (0.34) AGTR1AGTR2LTB4R2AGT
SCHEMBL9709716 0.76 AGT (0.41) AGTR1AGTR2AGT
SCHEMBL9709767 0.76 AGT (0.39) AGTR1AGTR2AGT
SCHEMBL9709690 0.75 AGTR1 (0.44) AGTR1AGTR2LTB4R2AGT
SCHEMBL9709627 0.75 AGTR1 (0.38) AGTR1AGTR2AGT
SCHEMBL9709712 0.75 AGT (0.41) AGTR1AGTR2AGT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3083582-B1 A NEW PROCESS FOR THE PREPARATION OF CANDESARTAN CILEXETIL FARMA GRS D O O (SI) 2019-06-26 EP claimed