SCHEMBL9704087

SCHEMBL9704087

CCCCc1nc2ccc(NC(=O)C3CCCCC3C(N)=O)nc2n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGT P01019 2/20 0.53
AGTR1 P30556 2/20 0.50
AGTR2 P50052 2/20 0.50

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
SCHEMBL9703957 0.88 AGTR1 (0.58) AGTAGTR1AGTR2
SCHEMBL9704718 0.84 AGTR1 (0.43) AGTR1AGTR2
SCHEMBL9705962 0.81 AGTR1 (0.57) AGTAGTR1AGTR2
SCHEMBL9704814 0.80 AGT (0.58) AGTAGTR1AGTR2
SCHEMBL9704808 0.80 AGT (0.58) AGTAGTR1AGTR2
SCHEMBL9704796 0.78 AGT (0.57) AGTAGTR1AGTR2
SCHEMBL9705259 0.78 AGT (0.57) AGTAGTR1AGTR2
SCHEMBL8393782 0.77 AGTR1 (0.73) AGTAGTR1AGTR2
SCHEMBL9854421 0.77 AGTR1 (0.62) AGTAGTR1AGTR2
SCHEMBL9704341 0.76 AGTR1 (0.58) AGTAGTR1AGTR2

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-0470543-A1 Heterocyclic imidazoles, remedies containing them and processes for their preparation Dr. Karl Thomae GmbH (DE) 1992-02-12 EP disclosed