SCHEMBL2051830

SCHEMBL2051830

CC(C)(C)OC(=O)Nc1ncsc1I

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.39
ATR Q13535 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
PSMB8 P28062 1/20 0.36
CYP17A1 P05093 2/20 0.35
LCK P06239 4/20 0.34
NAMPT P43490 1/20 0.34
MAP4K4 O95819 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
SREBF2 Q12772 1/20 0.33

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
SCHEMBL24114113 0.83 METAP1 (0.40) METAP1ATRCA1CA2PSMB8
SCHEMBL21644748 0.81 METAP1 (0.39) METAP1ATRCA1CA2PSMB8
SCHEMBL4304797 0.80 KDM4E (0.45) METAP1ATRCA1CA2PSMB8
SCHEMBL25179955 0.80 ATR (0.40) METAP1ATRCA1CA2PSMB8
SCHEMBL30992827 0.79 METAP1 (0.40) METAP1ATRCA1CA2PSMB8
SCHEMBL25180969 0.79 ATR (0.45) METAP1ATRCA1CA2PSMB8
SCHEMBL25179953 0.79 METAP1 (0.38) METAP1ATRCA1CA2PSMB8
SCHEMBL20846078 0.75 METAP1 (0.35) METAP1ATRCA1CA2PSMB8
SCHEMBL15264820 0.74 ATR (0.48) METAP1ATRCA1CA2PSMB8
SCHEMBL26848070 0.74 LCK (0.41) METAP1ATRCA1CA2PSMB8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2513071-B1 THIAZOLEDERIVATES FOR THE TREATMENT OF DISEASES SUCH AS CANCER MERCK PATENT GMBH (DE) 2015-06-17 EP claimed
US-12486289-B2 Tricyclic compounds as glycogen synthase kinase 3 (GSK3) inhibitors and uses thereof THE BROAD INSTITUTE, INC. (US) 2025-12-02 US disclosed
US-20250340574-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMA (US) 2025-11-06 US disclosed
EP-4626860-A1 FUSED PYRROLYL-SULFONAMIDE COMPOUNDS ReWind Therapeutics NV (BE) 2025-10-08 EP disclosed
EP-4504739-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR Vertex Pharmaceuticals Incorporated (US) 2025-02-12 EP disclosed
WO-2024115733-A1 FUSED PYRROLYL-SULFONAMIDE COMPOUNDS REWIND THERAPEUTICS NV (BE) 2024-06-06 WO disclosed
WO-2023196429-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-10-12 WO disclosed
WO-2023196429-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-10-12 WO disclosed
CN-110958882-B Tricyclic compounds as glycogen synthase kinase 3 (GSK 3) inhibitors and uses thereof 布罗德研究所股份有限公司 2023-08-29 CN disclosed
US-20220112216-A1 TRICYCLIC COMPOUNDS AS GLYCOGEN SYNTHASE KINASE 3 (GSK3) INHIBITORS AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2022-04-14 US disclosed
US-8703961-B2 Thiazole derivatives for the treatment of diseases such as cancer MERCK PATENT GMBH (DE) 2014-04-22 US disclosed
US-20140107126-A1 NOVEL INHIBITOR COMPOUNDS OF PHOSPHODIESTERASE TYPE 10A AbbVie Deutschland GmbH & Co. KG (DE) 2014-04-17 US disclosed
WO-2014041175-A1 NOVEL INHIBITOR COMPOUNDS OF PHOSPHODIESTERASE TYPE 10A ABBOTT GMBH & CO. KG (DE) 2014-03-20 WO disclosed
EP-2513071-A1 THIAZOLE DERIVATIVES FOR TREATING DISEASES SUCH AS CANCER Merck Patent GmbH (DE) 2012-10-24 EP disclosed
US-20120252759-A1 THIAZOLE DERIVATIVES FOR THE TREATMENT OF DISEASES SUCH AS CANCER MERCK PATENT GESELLSCHAFT MIT BESCHRANKER HAFTING (DE) 2012-10-04 US disclosed
US-20120252759-A1 THIAZOLE DERIVATIVES FOR THE TREATMENT OF DISEASES SUCH AS CANCER MERCK PATENT GESELLSCHAFT MIT BESCHRANKER HAFTING (DE) 2012-10-04 US disclosed
US-20120252759-A1 THIAZOLE DERIVATIVES FOR THE TREATMENT OF DISEASES SUCH AS CANCER MERCK PATENT GESELLSCHAFT MIT BESCHRANKER HAFTING (DE) 2012-10-04 US disclosed
CN-102666509-A Thiazole derivatives for treating diseases such as cancer MERCK PATENT GMBH 2012-09-12 CN disclosed
WO-2011072779-A1 THIAZOLE DERIVATIVES FOR TREATING DISEASES SUCH AS CANCER MERCK PATENT GMBH (DE) 2011-06-23 WO disclosed
WO-2011072779-A1 THIAZOLE DERIVATIVES FOR TREATING DISEASES SUCH AS CANCER MERCK PATENT GMBH (DE) 2011-06-23 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 (5 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-20220112216-A1 TRICYCLIC COMPOUNDS AS GLYCOGEN SYNTHASE KINASE 3 (GSK3) INHIBITORS AND USES THEREOF GSK3A, GSK3B, PYGB METAP1 1489/4885ATR 102/4885CA1 570/4885
US-20120252759-A1 THIAZOLE DERIVATIVES FOR THE TREATMENT OF DISEASES SUCH AS CANCER RET, IGF1R, JAK2 METAP1 2901/4885ATR 1146/4885CA1 3363/4885
US-20250340574-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B METAP1 1200/4885ATR 4143/4885CA1 4877/4885
US-20140107126-A1 NOVEL INHIBITOR COMPOUNDS OF PHOSPHODIESTERASE TYPE 10A PDE5A, PDE1A, PDE1B METAP1 2366/4885ATR 2400/4885CA1 1541/4885
US-12486289-B2 Tricyclic compounds as glycogen synthase kinase 3 (GSK3) inhibitors and uses thereof GSK3A, GSK3B, PYGB METAP1 1489/4885ATR 102/4885CA1 570/4885

“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.