SCHEMBL119702

SCHEMBL119702

CC(C)(C)SC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 3/20 0.55
TP53 P04637 3/20 0.55
SLC17A5 Q9NRA2 1/20 0.54
CASP3 P42574 2/20 0.52
TLR2 O60603 2/20 0.49
MDM2 Q00987 4/20 0.49

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
SCHEMBL1491458 1.00 MDM4 (0.55) MDM4TP53SLC17A5CASP3TLR2
SCHEMBL1491454 1.00 MDM4 (0.55) MDM4TP53SLC17A5CASP3TLR2
SCHEMBL29401132 1.00 MDM4 (0.55) MDM4TP53SLC17A5CASP3TLR2
SCHEMBL29400299 1.00 MDM4 (0.55) MDM4TP53SLC17A5CASP3TLR2
SCHEMBL4404683 0.91 PTPN1 (0.49) MDM4TP53SLC17A5
SCHEMBL12088806 0.90 MDM4 (0.48) MDM4TP53SLC17A5CASP3MDM2
SCHEMBL3492803 0.89 MDM4 (0.54) MDM4TP53SLC17A5CASP3TLR2
SCHEMBL10020438 0.89 MDM4 (0.54) MDM4TP53SLC17A5CASP3TLR2
SCHEMBL1739174 0.89 MDM4 (0.54) MDM4TP53SLC17A5CASP3TLR2
SCHEMBL22636161 0.89 MDM4 (0.54) MDM4TP53SLC17A5CASP3TLR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1858538-B1 MUCIN HYPERSECRETION INHIBITORS BASED ON THE STRUCTURE OF MANS AND METHODS OF USE BIOMARCK PHARMACEUTICALS LTD (US) 2019-03-27 EP disclosed
EP-3347372-A1 PEPTIDOMIMETIC MACROCYCLES AS MODULATORS OF MCL-1 Aileron Therapeutics, Inc. (US) 2018-07-18 EP disclosed
US-9598463-B2 Mucin hypersecretion inhibitors and methods of use BIOMARCK PHARMACEUTICALS, LTD. (US) 2017-03-21 US disclosed
WO-2017044633-A1 PEPTIDOMIMETIC MACROCYCLES AS MODULATORS OF MCL-1 AILERON THERAPEUTICS, INC. (US) 2017-03-16 WO disclosed
US-20160287563-A1 Cysteine Prodrugs PROMENTIS PHARMACEUTICALS, INC. (US) 2016-10-06 US disclosed
US-20160287563-A1 Cysteine Prodrugs PROMENTIS PHARMACEUTICALS, INC. (US) 2016-10-06 US disclosed
US-9457014-B2 Cysteine prodrugs PROMENTIS PHARMACEUTICALS, INC. (US) 2016-10-04 US disclosed
US-9457014-B2 Cysteine prodrugs PROMENTIS PHARMACEUTICALS, INC. (US) 2016-10-04 US disclosed
US-20160081987-A1 Cysteine Prodrugs PROMENTIS PHARMACEUTICALS, INC. (US) 2016-03-24 US disclosed
US-20160081987-A1 Cysteine Prodrugs PROMENTIS PHARMACEUTICALS, INC. (US) 2016-03-24 US disclosed
US-7524926-B2 Mucin hypersecretion inhibitors and methods of use BIOMARCK PHARMACEUTICALS, LTD. (US) 2009-04-28 US disclosed
CN-101146545-A Mucin hypersecretion inhibitors based on the structure of MANS and methods of use BIOMARCK PHARMACEUTICALS LTD (US) 2008-03-19 CN disclosed
US-20060205664-A1 Mucin hypersecretion inhibitors and methods of use WILLIAMS, MASON L. 2006-09-14 US disclosed
US-6887890-B2 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-05-03 US disclosed
US-20030162724-A1 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-28 US disclosed
EP-1291341-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-12 EP disclosed
US-6372883-B1 FOR THERAPY AND PROPHYLAXIS OF INFECTIONS CAUSED BY HEPATITIS C, HEPATITIS G AND HUMAN GB VIRUSES HOFFMANN-LA ROCHE INC. 2002-04-16 US disclosed
US-5861477-A POLYPEPTIDES AS TISSUE PLASMINOGEN ACTIVATOR ATASSI M ZOUHAIR (US) 1999-01-19 US disclosed
US-5759834-A SYNTHETIC POLYPEPTIDE AS CATALYST ATASSI M ZOUHAIR (US) 1998-06-02 US disclosed
US-5576216-A Universal standard reagents, method of preparing same and use thereof Patchornik, Zipora (IL) 1996-11-19 US 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-20030162724-A1 Compounds exhibiting thrombopoietin-like activities MPL, THPO, TEK MDM4 3716/4885TP53 3089/4885SLC17A5 2659/4885
US-20160287563-A1 Cysteine Prodrugs SLC7A11, GCLC, CTH MDM4 2572/4885TP53 1421/4885SLC17A5 1110/4885
US-20160081987-A1 Cysteine Prodrugs SLC7A11, GCLC, CTH MDM4 2572/4885TP53 1421/4885SLC17A5 1110/4885

“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.