SCHEMBL7428737

SCHEMBL7428737

CC(C)(C)OC(=O)C(N)c1ccc2c(c1)C(CC(=O)O)CO2

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 17/20 0.44
PPARG P37231 12/20 0.44
PPARD Q03181 12/20 0.44
PPARA Q07869 1/20 0.39

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
SCHEMBL10444215 0.83 ACE (0.44)
SCHEMBL7425055 0.78 TP53 (0.32)
SCHEMBL7435758 0.76 TP53 (0.34) FFAR1PPARGPPARD
SCHEMBL7684870 0.74 EDNRA (0.57)
SCHEMBL7428732 0.73 SMN1; SMN2 (0.44) FFAR1PPARGPPARDPPARA
SCHEMBL7438336 0.72 EDNRA (0.39)
SCHEMBL10443920 0.71 PPARG (0.50) FFAR1PPARGPPARDPPARA
SCHEMBL9628106 0.71 PPARD (0.56) FFAR1PPARGPPARDPPARA
SCHEMBL25146389 0.70 PPARG (0.55) FFAR1PPARGPPARDPPARA
SCHEMBL6214519 0.69 FFAR1 (0.59) FFAR1PPARGPPARDPPARA

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-0375451-A2 Compounds having a renin-inhibiting activity BEECHAM GROUP PLC (GB) 1990-06-27 EP disclosed