SCHEMBL28630859

SCHEMBL28630859

CSCC[C@@H]([C]=O)NC(=O)c1cccc(CNC(=O)OC(C)(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FNTA P49354 10/20 0.49
FNTB P49356 10/20 0.49
PGGT1B P53609 2/20 0.48
GLS O94925 1/20 0.41
ROCK2 O75116 1/20 0.41
ROCK1 Q13464 1/20 0.41
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
TSHR P16473 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
BACE1 P56817 2/20 0.39

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
SCHEMBL28634860 0.81 FNTA (0.48) FNTAFNTBPGGT1B
SCHEMBL20474743 0.77 HDAC6 (0.56) GLSLMNA
SCHEMBL21224429 0.77 FNTA (0.49) FNTAFNTBPGGT1BROCK2ROCK1
SCHEMBL21224427 0.77 FNTA (0.49) FNTAFNTBPGGT1BROCK2ROCK1
SCHEMBL6625943 0.76 MMP13 (0.51) GLSROCK2ROCK1LMNA
SCHEMBL31044413 0.75 GLS (0.49) GLSTSHR
SCHEMBL27485284 0.75 CTSK (0.56) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL3819093 0.75 CTSK (0.56) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL2402075 0.75 CTSK (0.56) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL13135999 0.74 GLS (0.50) GLSTSHR

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
CN-113301920-A Complexes comprising ligands, spacers, peptide linkers and biomolecules 安斯泰来制药株式会社 2021-08-24 CN disclosed
CN-113271973-A Complex comprising a ligand and a CEACAM5 antibody Fab fragment 安斯泰来制药株式会社 2021-08-17 CN disclosed