SCHEMBL1682822

SCHEMBL1682822

O=C(NC1CC1)c1cccc(-c2csc3cnc(Cl)nc23)c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 12/20 0.48
L3MBTL1 Q9Y468 1/20 0.43
MAPK14 Q16539 1/20 0.43
POLQ O75417 1/20 0.43
MAP4K4 O95819 1/20 0.43
ATR Q13535 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SYK P43405 1/20 0.42

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
SCHEMBL1682850 0.88 PTK2 (0.55) PTK2MAPK14POLQMAP4K4ATR
SCHEMBL1682860 0.85 PTK2 (0.57) PTK2L3MBTL1MAP4K4NPC1RAB9A
SCHEMBL1682792 0.80 PTK2 (0.56) PTK2
SCHEMBL1682796 0.73 PTK2 (0.50) PTK2MAP4K4NPC1RAB9ASYK
SCHEMBL13519120 0.72 PTK2 (0.41) PTK2ATR
SCHEMBL12398419 0.72 PTK2 (0.45) PTK2SYK
SCHEMBL1674327 0.72 PTK2 (0.44) PTK2NPC1RAB9ASYK
SCHEMBL1682852 0.71 PTK2 (0.60) PTK2MAP4K4ATR
SCHEMBL19102523 0.71 SYK (0.50) L3MBTL1NPC1RAB9ASYK
SCHEMBL1682825 0.70 PTK2 (0.52) PTK2NPC1RAB9A

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 6 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 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 292/4885L3MBTL1 3112/4885MAPK14 120/4885

“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.