SCHEMBL1682811

SCHEMBL1682811

CCS(=O)(=O)Nc1cccc(-c2csc3cnc(Nc4ccc(N5CCOCC5)nc4)nc23)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 16/20 0.71
JAK1 P23458 2/20 0.61
JAK3 P52333 2/20 0.61
LCK P06239 1/20 0.61
FYN P06241 1/20 0.61
FES P07332 1/20 0.61
RET P07949 1/20 0.61
ROS1 P08922 1/20 0.61
CDK4 P11802 1/20 0.61
SRC P12931 1/20 0.61
TYK2 P29597 1/20 0.61
EPHB1 P54762 1/20 0.61
CSNK2A1 P68400 1/20 0.61
DDR1 Q08345 1/20 0.61
KCNH2 Q12809 1/20 0.61
JAK2 O60674 4/20 0.57
BRD4 O60885 4/20 0.57
BRD2 P25440 1/20 0.52
BRD3 Q15059 1/20 0.52
BRDT Q58F21 1/20 0.52

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
SCHEMBL1682793 0.92 PTK2 (0.83) PTK2JAK1JAK3LCKFYN
SCHEMBL1682885 0.89 PTK2 (0.69) PTK2JAK1JAK3LCKFYN
SCHEMBL1682878 0.87 PTK2 (0.65) PTK2JAK1JAK3LCKFYN
SCHEMBL1682873 0.86 PTK2 (0.61) PTK2JAK1JAK3LCKFYN
SCHEMBL1682871 0.85 PTK2 (0.62) PTK2JAK1JAK3LCKFYN
SCHEMBL1682851 0.84 PTK2 (0.61) PTK2JAK1JAK3LCKFYN
SCHEMBL1682829 0.84 PTK2 (0.83) PTK2JAK1JAK3LCKFYN
SCHEMBL13558193 0.84 PTK2 (0.61) PTK2JAK1JAK3LCKFYN
SCHEMBL1682830 0.84 PTK2 (0.69) PTK2JAK1JAK3LCKFYN
Hydrochloric Acid SCHEMBL1682882 0.84 PTK2 (0.81) PTK2JAK1JAK3LCKFYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8586580-B2 2,7-substituted thieno[3,2-d] pyrimidine compounds as protein kinase inhibitors KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-11-19 US claimed
US-20120277424-A1 2,7-SUBSTITUTED THIENO[3,2-D] PYRIMIDINE COMPOUNDS AS PROTEIN KINASE INHIBITORS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-11-01 US claimed
EP-2491043-A2 2,7-SUBSTITUTED THIENO[3,2-D]PYRIMIDINE COMPOUNDS AS PROTEIN KINASE INHIBITORS KIST Korea Institute of Science and Technology (KR) 2012-08-29 EP claimed
WO-2011049332-A2 2,7-SUBSTITUTED THIENO[3,2-D]PYRIMIDINE COMPOUNDS AS PROTEIN KINASE INHIBITORS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2011-04-28 WO claimed
US-8586580-B2 2,7-substituted thieno[3,2-d] pyrimidine compounds as protein kinase inhibitors KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-11-19 US disclosed
US-8586580-B2 2,7-substituted thieno[3,2-d] pyrimidine compounds as protein kinase inhibitors KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-11-19 US disclosed
US-20120277424-A1 2,7-SUBSTITUTED THIENO[3,2-D] PYRIMIDINE COMPOUNDS AS PROTEIN KINASE INHIBITORS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-11-01 US disclosed
US-20120277424-A1 2,7-SUBSTITUTED THIENO[3,2-D] PYRIMIDINE COMPOUNDS AS PROTEIN KINASE INHIBITORS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-11-01 US disclosed
US-20120277424-A1 2,7-SUBSTITUTED THIENO[3,2-D] PYRIMIDINE COMPOUNDS AS PROTEIN KINASE INHIBITORS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-11-01 US disclosed
EP-2491043-A2 2,7-SUBSTITUTED THIENO[3,2-D]PYRIMIDINE COMPOUNDS AS PROTEIN KINASE INHIBITORS KIST Korea Institute of Science and Technology (KR) 2012-08-29 EP disclosed
WO-2011049332-A2 2,7-SUBSTITUTED THIENO[3,2-D]PYRIMIDINE COMPOUNDS AS PROTEIN KINASE INHIBITORS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2011-04-28 WO disclosed
WO-2011049332-A2 2,7-SUBSTITUTED THIENO[3,2-D]PYRIMIDINE COMPOUNDS AS PROTEIN KINASE INHIBITORS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2011-04-28 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 (1 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-20120277424-A1 2,7-SUBSTITUTED THIENO[3,2-D] PYRIMIDINE COMPOUNDS AS PROTEIN KINASE INHIBITORS CDK2, TK1, DTYMK PTK2 292/4885JAK1 96/4885JAK3 177/4885

“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.