SCHEMBL1401403

SCHEMBL1401403

CCC(C(=O)O)[C@@H]1CCc2cc(OCCCOc3ccc(-c4cccc(C)n4)cc3)ccc21

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.69
PPARD Q03181 1/20 0.69
PPARG P37231 17/20 0.67

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
SCHEMBL1400992 0.83 PPARG (0.70) PPARAPPARG
SCHEMBL1400481 0.82 PPARG (0.60) PPARAPPARG
SCHEMBL1400607 0.82 PPARA (0.72) PPARAPPARG
SCHEMBL1400382 0.81 PPARD (1.00) PPARAPPARD
SCHEMBL1400706 0.81 PPARG (0.67) PPARAPPARG
SCHEMBL1400724 0.81 PPARA (0.72) PPARAPPARG
SCHEMBL1400436 0.81 PPARG (0.61) PPARAPPARG
SCHEMBL1400383 0.80 PPARD (0.66) PPARAPPARDPPARG
SCHEMBL1400245 0.80 PPARG (0.62) PPARAPPARG
SCHEMBL1400200 0.80 PPARG (0.62) PPARAPPARG

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-1578715-B1 INDANE ACETIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS, INTERMEDIATES, AND METHOD OF PREPARATION BAYER PHARMACEUTICALS CORP (US) 2011-03-02 EP disclosed