SCHEMBL4833852

SCHEMBL4833852

CN(C)C1=c2ccoc2=NCN1c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.39
▸ ALDH1A1 P00352 7/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ MAPT P10636 9/20 0.36
▸ SIRT6 Q8N6T7 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ LMNA P02545 3/20 0.35
▸ HTT P42858 1/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ AKR1C3 P42330 1/20 0.34
▸ ABCG2 Q9UNQ0 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ CRHBP P24387 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34

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
SCHEMBL4828976 0.78 L3MBTL1 (0.44) POLBALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL4833970 0.70 CA12 (0.52) POLBALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL4836580 0.61 MAPT (0.41) POLBALDH1A1MAPTSIRT6SMN1; SMN2
SCHEMBL31011685 0.59 MAPT (0.56) POLBALDH1A1MAPK1MAPTSIRT6
Iodide SCHEMBL10484653 0.59 MAPT (0.72) POLBALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL1208101 0.58 SMN1; SMN2 (0.72) POLBALDH1A1MAPTSIRT6SMN1; SMN2
SCHEMBL218018 0.58 MAPT (0.78) POLBALDH1A1MAPK1MAPTSMN1; SMN2
SCHEMBL1365889 0.57 MAPT (0.68) POLBALDH1A1MAPK1MAPTSIRT6
SCHEMBL5563084 0.57 ACHE (0.51) POLBALDH1A1MAPTSIRT6LMNA
SCHEMBL11183530 0.57 MAPT (0.53) POLBALDH1A1MAPTSIRT6LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF ADAMS JERRY LEROY 2008-11-20 — — US claimed
US-20050004142-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2005-01-06 — — US claimed
EP-1425284-A2 FURO- AND THIENOPYRIMIDINE DERIVATIVES AS ANGIOGENESIS INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-06-09 — — EP claimed
WO-2003022852-A2 FURO-AND THIENOPYRIMIDINE DERIVATIVES AS ANGIOGENESIS INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-03-20 — — WO claimed
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF ADAMS JERRY LEROY 2008-11-20 — — US disclosed
US-7427623-B2 4-Amino-2,3-disubstituted thieno[2,3-d]pyrimidines and pharmacetical compositions thereof SMITHKLINE BEECHAM CORPORATION (US) 2008-09-23 — — US disclosed
US-20050004142-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2005-01-06 — — US disclosed
EP-1425284-A2 FURO- AND THIENOPYRIMIDINE DERIVATIVES AS ANGIOGENESIS INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-06-09 — — EP disclosed
WO-2003022852-A2 FURO-AND THIENOPYRIMIDINE DERIVATIVES AS ANGIOGENESIS INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-03-20 — — 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 (2 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-20050004142-A1 Chemical compounds TIE1, KDR, TEK POLB 928/4885ALDH1A1 906/4885MAPK1 1410/4885
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF TIE1, TEK, KDR POLB 1327/4885ALDH1A1 1144/4885MAPK1 2207/4885

“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.

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