SCHEMBL29008355

SCHEMBL29008355

CCC(Oc1cccc(CN(CCCBr)c2nc3ccccc3o2)c1)C(=O)O

nearest known ligand 0.87

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 0.87
PPARD Q03181 19/20 0.87
PPARG P37231 14/20 0.87

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
SCHEMBL29008354 1.00 PPARA (0.87) PPARAPPARDPPARG
SCHEMBL14583366 0.93 PPARA (1.00) PPARAPPARDPPARG
SCHEMBL14583538 0.93 PPARA (1.00) PPARAPPARDPPARG
SCHEMBL2436060 0.92 PPARA (0.85) PPARAPPARDPPARG
SCHEMBL2438194 0.91 PPARA (0.84) PPARAPPARDPPARG
SCHEMBL1009478 0.91 PPARA (0.84) PPARAPPARDPPARG
SCHEMBL6543208 0.91 PPARA (0.84) PPARAPPARDPPARG
SCHEMBL6543106 0.91 PPARA (0.83) PPARAPPARDPPARG
SCHEMBL14583414 0.90 PPARA (0.92) PPARAPPARDPPARG
Pemafibrate SCHEMBL2766188 0.89 PPARA (1.00) PPARAPPARDPPARG

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
CN-115991682-A Preparation method and application of culture Ma Beite-D4 广州佳途科技股份有限公司 2023-04-21 CN disclosed