SCHEMBL5839738

SCHEMBL5839738

CC(C)C(NS(C)(=O)=O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
MMP2 P08253 12/20 0.47
MMP9 P14780 12/20 0.47
MMP3 P08254 10/20 0.47
MMP13 P45452 10/20 0.47
MMP1 P03956 9/20 0.47
MMP7 P09237 9/20 0.47
ADAMTS4 O75173 3/20 0.47
MMP14 P50281 1/20 0.45
CA12 O43570 1/20 0.43
CA14 Q9ULX7 1/20 0.43
MMP8 P22894 1/20 0.42

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
SCHEMBL5839741 1.00 KDM4E (0.49) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL3529082 0.84 CA2 (0.40) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL3529081 0.84 CA2 (0.40) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL28757910 0.84 CA2 (0.40) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL18412644 0.81 CA14 (0.43) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL13048839 0.81 CA14 (0.43) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL13049836 0.81 CA14 (0.43) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL29612792 0.81 KDM4E (0.49) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL29613045 0.80 MME (0.40) KDM4EMMP2MMP9MMP3MMP13
SCHEMBL13612445 0.79 KDM4E (0.47) KDM4EMMP2MMP9MMP3MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3342599-B1 HEAT-SENSITIVE RECORDING MATERIAL SANKO CO LTD (JP) 2021-06-16 EP disclosed
CN-108025574-B Thermal recording medium 三光株式会社 2019-04-16 CN disclosed
US-10086634-B2 Heat-sensitive recording material SANKO CO., LTD. (JP) 2018-10-02 US disclosed
US-20180194151-A1 HEAT-SENSITIVE RECORDING MATERIAL SANKO CO., LTD. (JP) 2018-07-12 US disclosed
EP-3342599-A1 HEAT-SENSITIVE RECORDING MATERIAL Sanko Co., Ltd. (JP) 2018-07-04 EP disclosed
CN-108025574-A Thermal recording medium 三光株式会社 2018-05-11 CN disclosed
US-7132420-B2 Aspartic protease inhibitors THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2006-11-07 US disclosed
EP-1140846-B1 ASPARTIC PROTEASE INHIBITORS US GOV HEALTH & HUMAN SERV (US) 2006-04-05 EP disclosed
US-6960575-B2 For use as inhibitors of chymase SANTEN PHARMACEUTICAL CO., LTD. (JP) 2005-11-01 US disclosed
US-20050130941-A1 Methods of treating alzheimer's disease PHARMACIA & UPJOHN COMPANY LLC 2005-06-16 US disclosed
EP-1211249-A1 NOVEL THIAZINE OR PYRAZINE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-06-05 EP disclosed
EP-1140846-A1 ASPARTIC PROTEASE INHIBITORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2001-10-10 EP disclosed
WO-2000040558-A1 ASPARTIC PROTEASE INHIBITORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2000-07-13 WO disclosed
EP-0642530-B1 DERIVATIVES OF DOLASTATIN BASF AG (DE) 1998-08-12 EP disclosed
US-5753652-A Antiretroviral hydrazine derivatives NOVARTIS CORPORATION (US) 1998-05-19 US disclosed
EP-0521827-B1 Pharmacological active hydrazin derivatives and process for their preparation CIBA GEIGY AG (CH) 1996-09-25 EP disclosed
EP-0604368-B1 Anti retroviral hydrazine derivatives CIBA GEIGY AG (CH) 1996-09-18 EP disclosed
EP-0642530-A1 DERIVATIVES OF DOLASTATIN BASF Aktiengesellschaft (DE) 1995-03-15 EP disclosed
EP-0604368-A1 Anti retroviral hydrazine derivatives CIBA-GEIGY AG (CH) 1994-06-29 EP disclosed
EP-0521827-A1 Pharmacological active hydrazin derivatives and process for their preparation CIBA-GEIGY AG (CH) 1993-01-07 EP 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 (3 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-20180194151-A1 HEAT-SENSITIVE RECORDING MATERIAL ASIC1, SCN1A, NPR1 KDM4E 3830/4885MMP2 3267/4885MMP9 3602/4885
US-10086634-B2 Heat-sensitive recording material ASIC1, SCN1A, NPR1 KDM4E 3621/4885MMP2 3320/4885MMP9 3339/4885
US-20050130941-A1 Methods of treating alzheimer's disease BACE1, PSEN1, BACE2 KDM4E 3396/4885MMP2 45/4885MMP9 26/4885

“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.