SCHEMBL953385

SCHEMBL953385

CCOC(=O)c1sc(-c2ccncc2)nc1-c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 18/20 1.00
DBF4 Q9UBU7 18/20 1.00
TRPM8 Q7Z2W7 1/20 0.67
ALDH1A1 P00352 1/20 0.65
HSD17B10 Q99714 1/20 0.65
CCNE1 P24864 1/20 0.64
CDK2 P24941 1/20 0.64

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
SCHEMBL4503056 0.94 CDC7 (0.88) CDC7DBF4TRPM8ALDH1A1HSD17B10
SCHEMBL16039074 0.86 CDC7 (0.76) CDC7DBF4TRPM8ALDH1A1HSD17B10
SCHEMBL4478832 0.86 CDC7 (0.75) CDC7DBF4TRPM8ALDH1A1HSD17B10
SCHEMBL952275 0.84 CDC7 (0.73) CDC7DBF4TRPM8ALDH1A1HSD17B10
SCHEMBL957220 0.84 CDC7 (0.77) CDC7DBF4TRPM8ALDH1A1HSD17B10
SCHEMBL13576536 0.83 CDC7 (0.71) CDC7DBF4TRPM8ALDH1A1HSD17B10
SCHEMBL16037743 0.83 LMNA (0.74) CDC7DBF4TRPM8ALDH1A1HSD17B10
SCHEMBL16037691 0.83 CDC7 (0.71) CDC7DBF4TRPM8ALDH1A1HSD17B10
SCHEMBL5733147 0.83 CDC7 (1.00) CDC7DBF4TRPM8ALDH1A1
SCHEMBL15176802 0.82 CDC7 (0.70) CDC7DBF4TRPM8ALDH1A1HSD17B10

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160130241-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC Foundation for Research Development (10 pp.) 2016-05-12 US claimed
WO-2014160197-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2014-10-02 WO claimed
US-20140275178-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2014-09-18 US claimed
US-9850218-B2 Thiazole compounds, compositions and methods for treatment of degenerative diseases and disorders MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2017-12-26 US disclosed
US-9850218-B2 Thiazole compounds, compositions and methods for treatment of degenerative diseases and disorders MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2017-12-26 US disclosed
US-9850218-B2 Thiazole compounds, compositions and methods for treatment of degenerative diseases and disorders MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2017-12-26 US disclosed
US-20160130241-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC Foundation for Research Development (10 pp.) 2016-05-12 US disclosed
US-20160130241-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC Foundation for Research Development (10 pp.) 2016-05-12 US disclosed
US-20160130241-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC Foundation for Research Development (10 pp.) 2016-05-12 US disclosed
US-9139589-B2 Heteroaryls and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-09-22 US disclosed
US-9090601-B2 Thiazole derivatives MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-07-28 US disclosed
WO-2014160197-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2014-10-02 WO disclosed
US-20140275178-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2014-09-18 US disclosed
US-20140275178-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2014-09-18 US disclosed
US-20140275178-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2014-09-18 US disclosed
EP-2391619-A1 HETEROARYLS AND THEIR USE AS PI3K INHIBITORS Millennium Pharmaceuticals, Inc. (US) 2011-12-07 EP disclosed
US-20110003807-A1 Thiazole derivatives MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-01-06 US disclosed
US-20110003806-A1 Heteroaryls and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-01-06 US disclosed
WO-2010090716-A1 HETEROARYLS AND THEIR USE AS PI3K INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-08-12 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-20110003807-A1 Thiazole derivatives MTOR, RICTOR, AKT2 CDC7 601/4885DBF4 3288/4885TRPM8 2427/4885
US-20140275178-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS TTR, PPARG, PPARD CDC7 3287/4885DBF4 3834/4885TRPM8 2640/4885
US-20110003806-A1 Heteroaryls and uses thereof RICTOR, MTOR, AKT1S1 CDC7 1063/4885DBF4 3779/4885TRPM8 4834/4885
US-20160130241-A1 THIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT OF DEGENERATIVE DISEASES AND DISORDERS TTR, PPARG, PPARD CDC7 3287/4885DBF4 3834/4885TRPM8 2640/4885

“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.