SCHEMBL7494797

SCHEMBL7494797

CCOc1cccc(OCc2nc3ccc(OC)cc3n2C)c1OC(=O)CC

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.55
TP53 P04637 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL6555779 0.80 TNF (0.42) PPARG
SCHEMBL6555842 0.77 TSHR (0.52) PPARGSMN1; SMN2
SCHEMBL6557412 0.75 PDE10A (0.57)
SCHEMBL6557988 0.74 L3MBTL1 (0.51) PPARGSMN1; SMN2
SCHEMBL6055987 0.72 ALDH1A1 (0.47) SMN1; SMN2
Hydrochloric Acid SCHEMBL3487712 0.71 PPARG (0.74) PPARG
SCHEMBL6557586 0.71 KDM4E (0.52) PPARGSMN1; SMN2
SCHEMBL6700252 0.71 PPARA (0.57) PPARG
SCHEMBL6557322 0.71 KDM4E (0.52) PPARGSMN1; SMN2
SCHEMBL7617609 0.71 ALDH1A1 (0.46) SMN1; SMN2

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-1167357-A1 ALPHA-SUBSTITUTED CARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 2002-01-02 EP disclosed