SCHEMBL4826378

SCHEMBL4826378

NC1c2ccsc2N=CN1c1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.49
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ CA9 Q16790 1/20 0.49
▸ KIT P10721 6/20 0.47
▸ FLT3 P36888 6/20 0.47
▸ FLT1 P17948 4/20 0.47
▸ NTRK1 P04629 3/20 0.47
▸ NTRK2 Q16620 3/20 0.47
▸ LCK P06239 3/20 0.47
▸ CSF1R P07333 3/20 0.47
▸ FGFR1 P11362 3/20 0.47
▸ FGFR3 P22607 3/20 0.47
▸ PLK4 O00444 2/20 0.47
▸ AURKA O14965 2/20 0.47
▸ MAPK13 O15264 2/20 0.47
▸ PDPK1 O15530 2/20 0.47
▸ JAK2 O60674 2/20 0.47
▸ CHEK2 O96017 2/20 0.47
▸ ABL1 P00519 2/20 0.47

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
SCHEMBL4831099 0.90 MAPT (0.47) CA12CA1CA2CA9KIT
SCHEMBL4833818 0.87 RET (0.41) LCKJAK2RETKDRPDGFRB
SCHEMBL4825661 0.86 MAPT (0.48) KITFLT3AURKAKDRPDGFRB
SCHEMBL4833729 0.85 MEN1 (0.35) CA12CA1CA2CA9KIT
SCHEMBL4828962 0.84 CSF1R (0.39) LCKCSF1RAURKB
SCHEMBL4831342 0.82 CA12 (0.52) CA12CA1CA2CA9KIT
SCHEMBL4825803 0.81 CA12 (0.46) CA12CA1CA2CA9KIT
SCHEMBL4836655 0.80 CA12 (0.47) CA12CA1CA2CA9KIT
SCHEMBL4836423 0.79 KCNJ5 (0.36) KITFLT3NTRK1CSF1RABL1
SCHEMBL4836049 0.79 PSEN1 (0.46) NTRK1ROCK2RIPK1

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-7427623-B2 4-Amino-2,3-disubstituted thieno[2,3-d]pyrimidines and pharmacetical compositions thereof SMITHKLINE BEECHAM CORPORATION (US) 2008-09-23 — — 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 CA12 4081/4885CA1 4775/4885CA2 2721/4885
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF TIE1, TEK, KDR CA12 4813/4885CA1 4873/4885CA2 3685/4885

“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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