SCHEMBL3331855

SCHEMBL3331855

NNC(=O)C(CCO)NC(=O)CS

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.32
PTGS1 P23219 1/20 0.32
GSTK1 Q9Y2Q3 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
GNPAT O15228 1/20 0.30
ENPEP Q07075 1/20 0.30

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
SCHEMBL13301136 0.87 ENPEP (0.34) HIF1APTGS1GSTK1CA1CA2
SCHEMBL3326521 0.84 PTGS1 (0.37) HIF1APTGS1GSTK1CA1CA2
SCHEMBL21982096 0.81 CYP2C9 (0.38) HIF1ACA1CA2GNPAT
SCHEMBL4640801 0.79
SCHEMBL3328021 0.78 SIRT6 (0.40)
SCHEMBL18250982 0.77 CA1 (0.32) CA1CA2
SCHEMBL21335970 0.74 CA1 (0.34) HIF1ACA1CA2
SCHEMBL20125242 0.72 CA1 (0.38) HIF1ACA1CA2
SCHEMBL17399725 0.69 PTGS1 (0.33) PTGS1GSTK1
SCHEMBL21982097 0.69 HIF1A (0.34) HIF1ACA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3095467-B1 ANTIBODY-ENZYME CONJUGATE VENTANA MED SYST INC (US) 2020-05-06 EP disclosed
EP-2963011-B1 MOLECULAR CONJUGATE VENTANA MED SYST INC (US) 2018-05-09 EP disclosed
EP-2963011-B1 MOLECULAR CONJUGATE VENTANA MED SYST INC (US) 2018-05-09 EP disclosed
EP-3095467-A1 MOLECULAR CONJUGATE Ventana Medical Systems, Inc. (US) 2016-11-23 EP disclosed
US-20160195540-A1 Molecular Conjugate VENTANA MED SYST INC (US) 2016-07-07 US disclosed
US-20160195540-A1 Molecular Conjugate VENTANA MED SYST INC (US) 2016-07-07 US disclosed
US-9310373-B2 Molecular conjugate VENTANA MEDICAL SYSTEMS, INC. (US) 2016-04-12 US disclosed
US-9310373-B2 Molecular conjugate VENTANA MEDICAL SYSTEMS, INC. (US) 2016-04-12 US disclosed
EP-2963011-A1 MOLECULAR CONJUGATE Ventana Medical Systems, Inc. (US) 2016-01-06 EP disclosed
EP-2963011-A1 MOLECULAR CONJUGATE Ventana Medical Systems, Inc. (US) 2016-01-06 EP disclosed
EP-1951316-B1 Molecular conjugate VENTANA MED SYST INC (US) 2015-08-19 EP disclosed
US-20140205995-A1 MOLECULAR CONJUGATE VENTANA MEDICAL SYSTEMS, INC. (US) 2014-07-24 US disclosed
US-20140205995-A1 MOLECULAR CONJUGATE VENTANA MEDICAL SYSTEMS, INC. (US) 2014-07-24 US disclosed
US-20100136652-A1 Molecular Conjugate VENTANA MEDICAL SYSTEMS, INC. 2010-06-03 US disclosed
US-20100136652-A1 Molecular Conjugate VENTANA MEDICAL SYSTEMS, INC. 2010-06-03 US disclosed
US-20100136652-A1 Molecular Conjugate VENTANA MEDICAL SYSTEMS, INC. 2010-06-03 US disclosed
WO-2007062177-A2 MOLECULAR CONJUGATE VENTANA MEDICAL SYSTEMS, INC. (US) 2007-05-31 WO disclosed
US-20070117153-A1 Molecular conjugate VENTANA MEDICAL SYSTEMS, INC. 2007-05-24 US disclosed
US-20070117153-A1 Molecular conjugate VENTANA MEDICAL SYSTEMS, INC. 2007-05-24 US disclosed
US-20070117153-A1 Molecular conjugate VENTANA MEDICAL SYSTEMS, INC. 2007-05-24 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-20160195540-A1 Molecular Conjugate CA12, FCGR2A, CA14 HIF1A 3349/4885PTGS1 2352/4885GSTK1 61/4885
US-20100136652-A1 Molecular Conjugate CA12, FCGR2A, CA14 HIF1A 3349/4885PTGS1 2352/4885GSTK1 61/4885
US-20070117153-A1 Molecular conjugate CA12, FCGR2A, CA14 HIF1A 3349/4885PTGS1 2352/4885GSTK1 61/4885

“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.