SCHEMBL7010549

SCHEMBL7010549

CCOC(=O)CCCOc1ccc(C[C@H](Nc2nc3ccccc3o2)C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.51
ELANE P08246 1/20 0.51
PPARA Q07869 2/20 0.51

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
SCHEMBL6289055 0.90 ELANE (0.48) PPARGELANEPPARA
SCHEMBL6221383 0.86 PPARG (0.45) PPARGPPARA
SCHEMBL7018527 0.81 PPARG (0.43) PPARGELANEPPARA
SCHEMBL6221979 0.80 ITGB1 (0.53) PPARGPPARA
SCHEMBL1595460 0.79 PPARG (0.57) PPARGPPARA
SCHEMBL1596335 0.78 LMNA (0.49) PPARGPPARA
SCHEMBL4840891 0.78 ITGB1 (0.61) PPARGPPARA
SCHEMBL6221766 0.77 PPARG (0.48) PPARGPPARA
SCHEMBL3142352 0.77 ELANE (0.60) PPARGELANEPPARA
SCHEMBL5246611 0.76 ELANE (0.51) PPARGELANEPPARA

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-1282621-A1 VITRONECTIN RECEPTOR ANTAGONISTS Aventis Pharma S.A. (FR) 2003-02-12 EP disclosed
WO-2001085729-A1 NOVEL VITRONECTIN RECEPTOR ANTAGONISTS AVENTIS PHARMA S.A. (FR) 2001-11-15 WO disclosed