SCHEMBL4890607

SCHEMBL4890607

CCOC(Cc1ccc(OCC(=O)NCc2ccc(Cl)cc2)cc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.59
PPARG P37231 12/20 0.54
PPARD Q03181 7/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
ADAMTS5 Q9UNA0 1/20 0.50
SGMS1 Q86VZ5 1/20 0.50

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
SCHEMBL3963103 1.00 PPARA (0.59) PPARAPPARGPPARDMEN1KMT2A
SCHEMBL3968108 0.86 PPARA (0.60) PPARAPPARGPPARDADAMTS5
SCHEMBL3967493 0.86 PPARA (0.56) PPARAPPARGPPARD
SCHEMBL16082992 0.82 KMT2A (0.66) MEN1KMT2AADAMTS5SGMS1
SCHEMBL3969064 0.81 PPARA (0.60) PPARAPPARGPPARD
SCHEMBL4984036 0.80 PTPN1 (0.62) PPARAPPARGPPARD
SCHEMBL5721665 0.80 PPARA (0.53) PPARAPPARGPPARD
SCHEMBL4901621 0.79 PPARA (0.58) PPARAPPARGPPARD
SCHEMBL3963614 0.79 PPARA (0.58) PPARAPPARGPPARD
SCHEMBL14470660 0.79 PTPN1 (0.67) PPARAPPARGPPARD

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
US-7462644-B2 Therapeutic agents ASTRAZENECA AB (SE) 2008-12-09 US claimed