SCHEMBL4448170

SCHEMBL4448170

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

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.54
IL6ST P40189 1/20 0.44
KLK7 P49862 1/20 0.43
KLK5 Q9Y337 1/20 0.43
NAAA Q02083 1/20 0.41
IDH1 O75874 7/20 0.41
FAAH O00519 1/20 0.39
PPARG P37231 1/20 0.39
AGTR2 P50052 1/20 0.38
ABCB1 P08183 1/20 0.38

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
SCHEMBL13625847 1.00 PPARA (0.54) PPARAIL6STKLK7KLK5NAAA
SCHEMBL3689311 1.00 PPARA (0.54) PPARAIL6STKLK7KLK5NAAA
SCHEMBL31395216 0.93 PPARA (0.51) PPARAIL6STKLK7KLK5NAAA
SCHEMBL31395401 0.93 PPARA (0.51) PPARAIL6STKLK7KLK5NAAA
SCHEMBL22552723 0.92 PPARA (0.59) PPARAIL6STNAAAIDH1PPARG
SCHEMBL22552990 0.92 PPARA (0.59) PPARAIL6STNAAAIDH1PPARG
SCHEMBL20820036 0.92 PPARA (0.59) PPARAIL6STNAAAIDH1PPARG
SCHEMBL20825575 0.92 PPARA (0.59) PPARAIL6STNAAAIDH1PPARG
SCHEMBL28900400 0.92 PPARA (0.59) PPARAIL6STNAAAIDH1PPARG
SCHEMBL28900402 0.92 PPARA (0.59) PPARAIL6STNAAAIDH1PPARG

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119546577-A Modulators of G protein-coupled receptor 88 阿卡蒂亚药品公司 2025-02-28 CN disclosed
EP-3543229-B1 METHOD FOR PREPARING OPTICALLY PURE (R)-4-N-PROPYL-DIHYDROFURAN-2(3H)-ONE BEIJING ABLEPHARMTECH CO LTD (CN) 2021-04-14 EP disclosed
EP-3543229-A1 METHOD FOR PREPARING OPTICALLY PURE (R)-4-N-PROPYL-DIHYDROFURAN-2(3H)-ONE Beijing AblePharmtech Co., Ltd. (CN) 2019-09-25 EP disclosed
WO-2009136001-A1 PROTEIN KINASE MODULATING AGENTS TUOMINEN RAIMO (FI) 2009-11-12 WO disclosed