SCHEMBL23933858

SCHEMBL23933858

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

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSL P07711 11/20 0.43
CTSV O60911 10/20 0.43
CTSS P25774 10/20 0.43
CTSK P43235 8/20 0.43
CTSB P07858 8/20 0.43
APEX1 P27695 1/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
PNMT P11086 1/20 0.40
ALDH1A1 P00352 2/20 0.40
TAAR1 Q96RJ0 1/20 0.40
MAPT P10636 1/20 0.40
CNR1 P21554 1/20 0.40

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
SCHEMBL23933861 1.00 CTSL (0.43) CTSLCTSVCTSSCTSKCTSB
SCHEMBL23933860 1.00 CTSL (0.43) CTSLCTSVCTSSCTSKCTSB
SCHEMBL23933796 0.89 PNMT (0.43) CTSLCTSVCTSSCTSKCTSB
SCHEMBL23933798 0.89 PNMT (0.43) CTSLCTSVCTSSCTSKCTSB
SCHEMBL23933793 0.89 PNMT (0.43) CTSLCTSVCTSSCTSKCTSB
SCHEMBL23933856 0.79 PPARA (0.54) PPARGPPARAPNMT
SCHEMBL23933859 0.79 PPARA (0.54) PPARGPPARAPNMT
SCHEMBL23933762 0.78 MASP2 (0.42) ALDH1A1TAAR1MAPTCNR1
SCHEMBL23933765 0.78 MASP2 (0.42) ALDH1A1TAAR1MAPTCNR1
SCHEMBL23933763 0.76 SRR (0.50) PPARGPPARA

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