SCHEMBL479092

SCHEMBL479092

COC(=O)[C@H](CNC(=O)OC(C)(C)C)NC(=O)OCc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.71
CTSK P43235 7/20 0.55
KYNU Q16719 1/20 0.55
CTSS P25774 8/20 0.54
CTSL P07711 5/20 0.54
CTSB P07858 4/20 0.54
ALDH1A1 P00352 1/20 0.53
ALOX15 P16050 1/20 0.53
PPARA Q07869 1/20 0.52
KLK5 Q9Y337 1/20 0.50

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
SCHEMBL479093 1.00 SYK (0.71) SYKCTSKKYNUCTSSCTSL
SCHEMBL14496968 1.00 SYK (0.71) SYKCTSKKYNUCTSSCTSL
SCHEMBL14842312 0.95 SYK (0.64) SYKCTSKKYNUCTSSCTSL
SCHEMBL6231600 0.95 SYK (0.64) SYKCTSKKYNUCTSSCTSL
SCHEMBL3897638 0.94 SYK (0.72) SYKCTSKCTSSCTSLCTSB
SCHEMBL30460045 0.94 SYK (0.72) SYKCTSKCTSSCTSLCTSB
SCHEMBL23455619 0.92 SYK (0.61) SYKCTSKKYNUCTSSCTSL
SCHEMBL8174628 0.92 SYK (0.61) SYKCTSKKYNUCTSSCTSL
SCHEMBL615359 0.91 SYK (0.72) SYKCTSKCTSSCTSLCTSB
SCHEMBL615358 0.91 SYK (0.72) SYKCTSKCTSSCTSLCTSB

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107922394-B 3-tetrazolyl-benzene-1, 2-disulfonamide derivatives as metallo-beta-lactamase inhibitors 默沙东公司 2021-07-13 CN disclosed
EP-3313832-B1 3-TETRAZOLYL-BENZENE-1,2-DISULFONAMIDE DERIVATIVES AS METALLO-BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME (US) 2021-02-24 EP disclosed
EP-3390374-B1 HYDROXYALKYLAMINE- AND HYDROXYCYCLOALKYLAMINE-SUBSTITUTED DIAMINE-ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS MERCK SHARP & DOHME (US) 2020-08-26 EP disclosed
US-10544130-B2 Metallo-beta-lactamase inhibitors MERCK SHARP & DOHME CORP. (US) 2020-01-28 US disclosed
US-20190233406-A1 HYDROXYALKYLAMINE- and HYDROXYCYCLOALKYLAMINE-SUBSTITUTED DIAMINE-ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS MERCK SHARP & DOHME CORP. (US) 2019-08-01 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-10221167-B2 Hydroxyalkylamine- and hydroxycycloalkylamine-substituted diamine-arylsulfonamide compounds with selective activity in voltage-gated sodium channels MERCK SHARP & DOHME CORP. (US) 2019-03-05 US disclosed
EP-3390374-A1 HYDROXYALKYLAMINE- AND HYDROXYCYCLOALKYLAMINE-SUBSTITUTED DIAMINE-ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS Merck Sharp & Dohme Corp. (US) 2018-10-24 EP disclosed
US-20180244656-A1 METALLO-BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-08-30 US disclosed
EP-0664792-B1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO INC (US) 2000-01-05 EP disclosed
US-5789421-A PIPERIDINYL(METHOXY)-2-INDOLECARBONYL-2-PHENYLSULFONYLAMINO BETA-ALANINE AND SALTS FOR INHIBITING AGGREGATION OF BLOOD PLATELETS AS ANTICOAGULANTS MERCK & CO., INC. (US) 1998-08-04 US disclosed
US-5721253-A Fibrinogen receptor antagonists MERCK & CO., INC. (US) 1998-02-24 US disclosed
US-5707994-A USEFUL AS A PLATELET AGGREGATION INHIBITOR, CANCER METASTASIS INHIBITOR, WOUND HEALING AGENT OR A BONE RESORPTION INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-01-13 US disclosed
US-5559127-A ANTICOAGULANTS MERCK & CO., INC. (US) 1996-09-24 US disclosed
EP-0725059-A1 2,3-DIAMINOPROPIONIC ACID DERIVATIVE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-08-07 EP disclosed
US-5525617-A ANTICOAGULANT MERCK & CO., INC. (US) 1996-06-11 US disclosed
WO-1995017397-A1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1995-06-29 WO disclosed
US-5416099-A Fibrinogen receptor antagonists MERCK & CO., INC. (US) 1995-05-16 US disclosed
WO-1994008962-A1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1994-04-28 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 (6 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 784/4885CTSK 794/4885KYNU 2412/4885
US-10221163-B2 Metallo-beta-lactamase inhibitors MLX, ZFX, MMP12 SYK 703/4885CTSK 868/4885KYNU 2274/4885
US-20190144432-A1 METALLO-BETA-LACTAMASE INHIBITORS MLX, ZFX, MMP12 SYK 784/4885CTSK 794/4885KYNU 2412/4885
US-20190233406-A1 HYDROXYALKYLAMINE- and HYDROXYCYCLOALKYLAMINE-SUBSTITUTED DIAMINE-ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS SCN7A, TRPV1, TRPA1 SYK 2011/4885CTSK 1117/4885KYNU 2766/4885
US-20180244656-A1 METALLO-BETA-LACTAMASE INHIBITORS MLX, ZFX, MMP12 SYK 703/4885CTSK 868/4885KYNU 2274/4885
US-10221167-B2 Hydroxyalkylamine- and hydroxycycloalkylamine-substituted diamine-arylsulfonamide compounds with selective activity in voltage-gated sodium channels SCN7A, TRPV1, TRPA1 SYK 2011/4885CTSK 1117/4885KYNU 2766/4885

“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.