SCHEMBL9704748

SCHEMBL9704748

CCCCc1nc2ccc(N(CCCC)C(=O)NC3CCCCC3)nc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.64
AGTR2 P50052 3/20 0.64
MME P08473 1/20 0.53

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
SCHEMBL9704324 0.95 AGTR1 (0.65) AGTR1AGTR2
SCHEMBL9704753 0.91 AGTR1 (0.53) AGTR1AGTR2MME
SCHEMBL9704647 0.91 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL9704662 0.88 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL8392504 0.87 AGTR1 (0.73) AGTR1AGTR2
SCHEMBL9705168 0.87 AGTR1 (0.49) AGTR1AGTR2MME
SCHEMBL8394522 0.85 AGTR1 (0.72) AGTR1AGTR2
SCHEMBL8392111 0.85 AGTR1 (0.71) AGTR1AGTR2
SCHEMBL8393689 0.85 AGTR1 (0.71) AGTR1AGTR2
SCHEMBL9704470 0.85 AGTR1 (0.75) AGTR1AGTR2

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