SCHEMBL8359446

SCHEMBL8359446

Cc1nc2c(nc(C3CC3)n2-c2ccc(-c3ccccc3-c3nc(=S)o[nH]3)cc2)c(C)c1C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.33
PPARG P37231 2/20 0.33
AGTR2 P50052 1/20 0.32

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
SCHEMBL8588243 0.89 AGTR1 (0.34) AGTR1PPARGAGTR2
SCHEMBL8363428 0.84 AGTR1 (0.40) AGTR1PPARGAGTR2
SCHEMBL8363421 0.84 KDM4E (0.34) PPARG
SCHEMBL8363423 0.83 AGTR1 (0.32) AGTR1PPARGAGTR2
SCHEMBL8359564 0.82 AGTR1 (0.32) AGTR1PPARGAGTR2
SCHEMBL8364105 0.81 AGTR1 (0.35) AGTR1PPARGAGTR2
SCHEMBL8363470 0.81 PDE5A (0.32) AGTR1PPARG
SCHEMBL8364598 0.80 PI4KA (0.35) AGTR1PPARGAGTR2
SCHEMBL8356866 0.80 AGTR1 (0.34) AGTR1PPARGAGTR2
SCHEMBL8359912 0.78 AGTR1 (0.44) 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
US-5883111-A STRONG AND LONG-LASTING ACTION BY ORAL ADMINISTRATION; HYPOTENSIVE AGENTS; CARDIOTONIC AGENTS; ALZHEIMER'S DISEASE; TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-16 US disclosed