SCHEMBL9664770

SCHEMBL9664770

CCc1nc(C2CC2)c(C(=O)O)n1Cc1c2ccocc-2c(C(=O)OC)c1-c1ccccc1C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PDE4B Q07343 1/20 0.32
PDE7A Q13946 1/20 0.32
MME P08473 1/20 0.32
AGTR1 P30556 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
SCHEMBL8544609 0.92 TSHR (0.38) HSD17B10PDE4BPDE7A
SCHEMBL7308635 0.83
SCHEMBL9429570 0.80 ALDH1A1 (0.38) MMEAGTR1
SCHEMBL9663223 0.79 AGTR1 (0.30) AGTR1
SCHEMBL9309399 0.79 TSHR (0.34) AGTR1
SCHEMBL7310871 0.79 AGTR2 (0.37) AGTR1
SCHEMBL9311003 0.78 AGTR1 (0.35) AGTR1
SCHEMBL9663265 0.78 GRM2 (0.32)
SCHEMBL9429517 0.76 ALDH1A1 (0.36)
SCHEMBL9664761 0.75

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-0514198-A1 1H-Imidazol-1-yl-methyl benzofuran derivatives with the imidazolyl moiety being substituted by a cycloalkyl group GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed