SCHEMBL23933856

SCHEMBL23933856

CO[C@@H](Cc1cccc(Cl)c1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.54
PPARG P37231 15/20 0.54
PNMT P11086 1/20 0.51
SRR Q9GZT4 1/20 0.49
PPARD Q03181 3/20 0.47

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
SCHEMBL23933859 1.00 PPARA (0.54) PPARAPPARGPNMTSRRPPARD
SCHEMBL6071337 0.86 PNMT (0.54) PPARAPPARGPNMT
SCHEMBL15446258 0.84 SRR (0.68) PPARAPPARGPNMTSRR
SCHEMBL22264858 0.83 PPARG (0.56) PPARAPPARGSRRPPARD
SCHEMBL5383259 0.83 SRR (0.50) PPARAPPARGSRRPPARD
SCHEMBL22264856 0.83 PPARG (0.56) PPARAPPARGSRRPPARD
SCHEMBL31321016 0.83 PPARG (0.56) PPARAPPARGSRRPPARD
SCHEMBL9628212 0.81 SRR (0.70) PPARAPPARGSRRPPARD
SCHEMBL2517934 0.81 SRR (0.70) PPARAPPARGSRRPPARD
SCHEMBL16877217 0.81 SRR (0.70) PPARAPPARGSRRPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021217041-A1 N-SUBSTITUTED ALPHA-AMINO AND ALPHA-HYDROXY CARBOXAMIDE DERIVATIVES IMMVENTION THERAPEUTIX (US) 2021-10-28 WO disclosed
WO-2021217041-A1 N-SUBSTITUTED ALPHA-AMINO AND ALPHA-HYDROXY CARBOXAMIDE DERIVATIVES IMMVENTION THERAPEUTIX (US) 2021-10-28 WO disclosed