SCHEMBL7398702

SCHEMBL7398702

CCCc1nc(-c2ccccc2)c(C=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1.CCCc1nc(C(F)(F)C(F)(F)F)c(C(=O)Cc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)[nH]1.CCCc1nc(C(F)(F)C(F)(F)F)c(C(=O)O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1.CCCc1nc(C(F)(F)C(F)(F)F)c(CO)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 4/20 0.50
AGTR1 P30556 3/20 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
SCHEMBL7356650 0.97 AGTR2 (0.53) AGTR2AGTR1
SCHEMBL62 0.81 AGTR1 (0.73) AGTR2AGTR1
SCHEMBL7363748 0.80 AGTR1 (0.61) AGTR2AGTR1
SCHEMBL40 0.80 AGTR1 (0.43) AGTR2AGTR1
SCHEMBL317 0.78 AGTR1 (0.55) AGTR2AGTR1
SCHEMBL7362569 0.78 AGTR2 (0.72) AGTR2AGTR1
SCHEMBL39 0.77 AGTR2 (0.54) AGTR2AGTR1
SCHEMBL7366694 0.76 AGTR1 (0.56) AGTR2AGTR1
SCHEMBL186 0.76 AGTR1 (0.65) AGTR2AGTR1
SCHEMBL9328849 0.75 AGTR1 (0.64) AGTR2AGTR1

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
WO-1991015206-A1 TREATMENT OF GLAUCOMA AND OCULAR HYPERTENSION WITH IMIDAZOLE ANGIOTENSIN-II RECEPTOR ANTAGONISTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-10-17 WO claimed