SCHEMBL4790089

SCHEMBL4790089

CC(C)(C)c1ccc(OC(Cc2ccc(OCCOCc3ccccc3)cc2)C(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.63
PPARA Q07869 18/20 0.63

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
SCHEMBL4790590 0.90 PPARG (0.50) PPARGPPARA
SCHEMBL4757413 0.90 PPARG (0.50) PPARGPPARA
SCHEMBL2662588 0.85 PPARG (0.48) PPARGPPARA
SCHEMBL14304703 0.84 GPR88 (0.46) PPARGPPARA
SCHEMBL4757529 0.84 PPARG (0.56) PPARGPPARA
SCHEMBL4758642 0.84 PPARG (0.56) PPARGPPARA
SCHEMBL4789840 0.84 PPARG (0.56) PPARGPPARA
SCHEMBL5551026 0.82 KMT2A (0.53)
SCHEMBL5609291 0.81 PPARG (0.59) PPARGPPARA
SCHEMBL5609279 0.81 PPARG (0.59) PPARGPPARA

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
WO-2008010238-A2 ANTIDIABETIC AZABICYCLO [3. 1. 0] HEXAN COMPOUNDS LUPIN LIMITED (IN) 2008-01-24 WO disclosed