SCHEMBL18342134

SCHEMBL18342134

CCC(CNC(=O)OC(C)(C)C)NC(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.61
▸ CTSS P25774 8/20 0.47
▸ CTSK P43235 8/20 0.47
▸ MEN1 O00255 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ CTSL P07711 1/20 0.41
▸ CTSB P07858 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA7 P43166 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ CAPN1 P07384 1/20 0.36
▸ SERPINE1 P05121 1/20 0.36
▸ BRD4 O60885 1/20 0.36

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
SCHEMBL12885087 0.90 SYK (0.64) SYKCTSSCTSKMEN1GAA
SCHEMBL20974393 0.87 SYK (0.48) SYKCTSSCTSKMEN1GAA
SCHEMBL26339235 0.87 SYK (0.61) SYKCTSSCTSKMEN1GAA
SCHEMBL20974116 0.85 SYK (0.47) SYKCTSSCTSKMEN1GAA
SCHEMBL30695896 0.84 MEN1 (0.54) SYKCTSSCTSKMEN1GAA
SCHEMBL17571451 0.83 SYK (0.53) SYKCTSSCTSKMEN1GAA
SCHEMBL17571386 0.81 SYK (0.52) SYKCTSSCTSKMEN1GAA
SCHEMBL13055405 0.80 SYK (0.54) SYKCTSSCTSKMEN1GAA
SCHEMBL18063333 0.80 MEN1 (0.57) SYKCTSSCTSKMEN1GAA
SCHEMBL20480002 0.79 KMT2A (0.47) SYKCTSSCTSKMEN1GAA

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
EP-3313832-B1 3-TETRAZOLYL-BENZENE-1,2-DISULFONAMIDE DERIVATIVES AS METALLO-BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME (US) 2021-02-24 — — EP disclosed
US-10544130-B2 Metallo-beta-lactamase inhibitors MERCK SHARP & DOHME CORP. (US) 2020-01-28 — — US disclosed
US-20190144432-A1 METALLO-BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2019-05-16 — — US disclosed
US-10221163-B2 Metallo-beta-lactamase inhibitors MERCK SHARP & DOHME CORP. (US) 2019-03-05 — — US disclosed
US-20180244656-A1 METALLO-BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-08-30 — — US disclosed
EP-3313832-A1 3-TETRAZOLYL-BENZENE-1,2-DISULFONAMIDE DERIVATIVES AS METALLO-BETA-LACTAMASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2018-05-02 — — EP disclosed
WO-2016210215-A1 3-TETRAZOLYL-BENZENE-1,2-DISULFONAMIDE DERIVATIVES AS METALLO-BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-12-29 — — 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 (4 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-10544130-B2 Metallo-beta-lactamase inhibitors MLX, ZFX, MMP12 SYK 784/4885CTSS 307/4885CTSK 794/4885
US-10221163-B2 Metallo-beta-lactamase inhibitors MLX, ZFX, MMP12 SYK 703/4885CTSS 341/4885CTSK 868/4885
US-20190144432-A1 METALLO-BETA-LACTAMASE INHIBITORS MLX, ZFX, MMP12 SYK 784/4885CTSS 307/4885CTSK 794/4885
US-20180244656-A1 METALLO-BETA-LACTAMASE INHIBITORS MLX, ZFX, MMP12 SYK 703/4885CTSS 341/4885CTSK 868/4885

“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.

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