SCHEMBL4831172

SCHEMBL4831172

COc1ccc(Br)cc1S(=O)(=O)Nc1ccc(N2CN=c3occc3=C2N)cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALPL P05186 12/20 0.46
▸ LMNA P02545 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ TRIM24 O15164 1/20 0.43
▸ EDNRB P24530 2/20 0.43
▸ EDNRA P25101 2/20 0.43
▸ SHMT2 P34897 1/20 0.43
▸ BRD4 O60885 1/20 0.42
▸ HSPD1 P10809 1/20 0.41
▸ HSPE1 P61604 1/20 0.41

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
SCHEMBL4830867 0.90 LMNA (0.50) ALPLLMNAMAPT
SCHEMBL4836848 0.90 ALPL (0.51) ALPLLMNATRIM24BRD4
SCHEMBL4834359 0.85 MAPT (0.40) LMNAMAPTEDNRBEDNRA
SCHEMBL4830770 0.83 ALPL (0.48) ALPLLMNAMAPT
SCHEMBL4829045 0.81 KMT2A (0.41) LMNAMAPT
SCHEMBL4831475 0.79 KMT2A (0.52) LMNAMAPT
SCHEMBL4836858 0.79 KMT2A (0.38) LMNAMAPT
SCHEMBL4834107 0.79 ALDH1A1 (0.46) LMNAEDNRBEDNRA
SCHEMBL4833991 0.78 ALDH1A1 (0.49) LMNABRD4HSPD1HSPE1
SCHEMBL4833297 0.77 PKM (0.39) LMNAMAPT

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 7 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
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 ALPL 4488/4885LMNA 4230/4885MAPT 2499/4885
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF TIE1, TEK, KDR ALPL 4482/4885LMNA 4131/4885MAPT 2424/4885

“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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