SCHEMBL22201734

SCHEMBL22201734

COC(=O)C(NC(=O)C(NC(=O)OC(C)(C)C)c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.50
CTSK P43235 2/20 0.50
S1PR3 Q99500 2/20 0.44
MIF P14174 1/20 0.41
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
TACR3 P29371 2/20 0.40
GPR88 Q9GZN0 3/20 0.39
SCN9A Q15858 1/20 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
SCHEMBL1554126 0.94 CTSS (0.48) CTSSCTSKS1PR3MIFESR1
SCHEMBL2582580 0.94 CTSS (0.48) CTSSCTSKS1PR3MIFESR1
SCHEMBL1554122 0.94 CTSS (0.48) CTSSCTSKS1PR3MIFESR1
SCHEMBL15258988 0.90 CTSS (0.48) CTSSCTSKS1PR3MIFESR1
SCHEMBL17137904 0.88 CTSS (0.64) CTSSCTSKS1PR3GPR88SCN9A
SCHEMBL11355325 0.88 CTSS (0.54) CTSSCTSKS1PR3MIFGPR88
SCHEMBL17137905 0.88 CTSS (0.64) CTSSCTSKS1PR3GPR88SCN9A
SCHEMBL17137903 0.88 CTSS (0.64) CTSSCTSKS1PR3GPR88SCN9A
SCHEMBL15962588 0.87 CTSS (0.49) CTSSCTSKS1PR3MIFESR1
Water SCHEMBL11354352 0.86 CTSS (0.56) CTSSCTSKS1PR3MIFGPR88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242491-A1 DIMERS FROM BIOREACHABLE MOLECULES AS COPOLYMERS ZYMERGEN INC. (US) 2023-08-03 US disclosed
US-20230242491-A1 DIMERS FROM BIOREACHABLE MOLECULES AS COPOLYMERS ZYMERGEN INC. (US) 2023-08-03 US disclosed
US-20230242720-A1 MODULUS MODIFIERS AND FILMS THEREOF ZYMERGEN ACQUISITION SUB, INC. 2023-08-03 US disclosed
US-20230242720-A1 MODULUS MODIFIERS AND FILMS THEREOF ZYMERGEN ACQUISITION SUB, INC. 2023-08-03 US disclosed
WO-2022006023-A1 DIMERS FROM BIOREACHABLE MOLECULES AS COPOLYMERS ZYMERGEN INC. (US) 2022-01-06 WO disclosed
WO-2022006145-A1 MODULUS MODIFIERS AND FILMS THEREOF ZYMERGEN INC. (US) 2022-01-06 WO disclosed
WO-2020142450-A1 POLYMER COMPOSITIONS COMPRISING COMPOUNDS DERIVED FROM BIOLOGY ZYMERGEN INC. (US) 2020-07-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230242491-A1 DIMERS FROM BIOREACHABLE MOLECULES AS COPOLYMERS HDHD5, HAO2, ALAD CTSS 2969/4885CTSK 3611/4885S1PR3 4852/4885
US-20230242720-A1 MODULUS MODIFIERS AND FILMS THEREOF SHBG, PTMS, SERPINA6 CTSS 4283/4885CTSK 3923/4885S1PR3 4522/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.