SCHEMBL9203002

SCHEMBL9203002

CCCc1nc2c(C)c(CO)sc2n1Cc1ccc(OCc2ccccc2C(=O)O)cc1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.47
AGTR1 P30556 1/20 0.44
AGTR2 P50052 1/20 0.44

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
SCHEMBL9203008 0.86 AGTR1 (0.46) PPARGAGTR1AGTR2
SCHEMBL9530606 0.80 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9044726 0.75 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9196516 0.74 MRGPRX4 (0.38) AGTR1AGTR2
SCHEMBL9199463 0.73 PLA2G2A (0.36) AGTR1AGTR2
SCHEMBL9039836 0.73 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL812 0.73 AGTR1 (0.60) AGTR1AGTR2
SCHEMBL9195831 0.72 AGTR2 (0.46) PPARGAGTR2
SCHEMBL9041908 0.72 PDE4A (0.52) AGTR1AGTR2
SCHEMBL9203204 0.71 PLA2G2A (0.35) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0517812-A4 ANGIOTENSIN II ANTAGONISTS INCORPORATING A SUBSTITUTED BENZYL ELEMENT MERCK & CO INC (US) 1995-10-18 EP disclosed
EP-0517812-A1 ANGIOTENSIN II ANTAGONISTS INCORPORATING A SUBSTITUTED BENZYL ELEMENT MERCK & CO. INC. (US) 1992-12-16 EP disclosed