SCHEMBL27273113

SCHEMBL27273113

CC(C)[C@@H](F)C(=O)N1C(=O)OC[C@H]1Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.47
IL6ST P40189 1/20 0.45
NAAA Q02083 1/20 0.42
IDH1 O75874 8/20 0.41
FAAH O00519 1/20 0.40
CSNK2B P67870 1/20 0.37
CSNK2A1 P68400 1/20 0.37
AGTR2 P50052 1/20 0.37
HDAC1 Q13547 2/20 0.37

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
SCHEMBL15873519 0.90 PPARA (0.48) PPARAIL6STNAAAIDH1FAAH
SCHEMBL21113600 0.90 PPARA (0.48) PPARAIL6STNAAAIDH1FAAH
SCHEMBL24418522 0.88 IL6ST (0.52) PPARAIL6STNAAAIDH1FAAH
SCHEMBL5065686 0.87 PPARA (0.49) PPARAIL6STNAAAIDH1FAAH
SCHEMBL21153769 0.87 PPARA (0.49) PPARAIL6STNAAAIDH1FAAH
SCHEMBL5065685 0.87 PPARA (0.49) PPARAIL6STNAAAIDH1FAAH
SCHEMBL29116103 0.87 PPARA (0.42) PPARAIL6STNAAAIDH1FAAH
SCHEMBL19018907 0.85 PPARA (0.51) PPARAIL6STNAAAIDH1FAAH
SCHEMBL17582755 0.85 PPARA (0.47) PPARAIL6STNAAAIDH1FAAH
SCHEMBL17582725 0.85 PPARA (0.47) PPARAIL6STNAAAIDH1FAAH

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-2024121395-A1 IAP INHIBITORS, METHODS OF MAKING THE SAME AND USES THEREOF DEBIOPHARM INTERNATIONAL SA (CH) 2024-06-13 WO disclosed