SCHEMBL5342707

SCHEMBL5342707

COC(=O)Nc1nc2cc(Sc3ccc(NC(=O)Nc4cc(C(C)(C)C)on4)cc3)ccc2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.53
TEK Q02763 1/20 0.53
MMP1 P03956 1/20 0.52
RAF1 P04049 5/20 0.51
MAPK14 Q16539 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
NR1I2 O75469 1/20 0.51
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
MAPK13 O15264 1/20 0.48
MAPK12 P53778 1/20 0.48
MAPK11 Q15759 1/20 0.48
RIPK2 O43353 1/20 0.48
FLT3 P36888 7/20 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
SCHEMBL7097935 0.91 MEN1 (0.53) KDRRAF1MAPK14MEN1KMT2A
SCHEMBL5348217 0.87 RAF1 (0.64) KDRTEKRAF1MAPK14MAPK13
SCHEMBL5341717 0.81 RAF1 (0.59) KDRTEKRAF1MAPK14MAPK13
SCHEMBL5345802 0.81 LMNA (0.57) KDRTEKMMP1MAPK14MEN1
SCHEMBL5348312 0.80 TEK (0.67) KDRTEKMMP1RAF1MAPK14
SCHEMBL5342704 0.80 LMNA (0.48) KDRTEKMMP1MAPK14MEN1
SCHEMBL7101583 0.79 RAF1 (0.66) KDRRAF1MAPK14MEN1KMT2A
SCHEMBL5345014 0.78 KDR (0.67) KDRTEKMMP1RAF1MAPK14
SCHEMBL5344391 0.78 TEK (0.68) KDRTEKMMP1RAF1MAPK14
SCHEMBL23077831 0.77 LMNA (0.60) KDRTEKMMP1MAPK14MEN1

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-7238813-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-07-03 US claimed
US-20040082583-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2004-04-29 US claimed
US-20070249600-A1 CHEMICAL COMPOUNDS CHEUNG MUI 2007-10-25 US disclosed
US-20070249600-A1 CHEMICAL COMPOUNDS CHEUNG MUI 2007-10-25 US disclosed
US-20070249600-A1 CHEMICAL COMPOUNDS CHEUNG MUI 2007-10-25 US disclosed
US-7238813-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-07-03 US disclosed
US-7238813-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-07-03 US disclosed
US-7238813-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-07-03 US disclosed
US-20040082583-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2004-04-29 US 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-20070249600-A1 CHEMICAL COMPOUNDS TIE1, KDR, FLT4 KDR 2/4885TEK 5/4885MMP1 2829/4885
US-20040082583-A1 Chemical compounds TIE1, KDR, FLT4 KDR 2/4885TEK 5/4885MMP1 2829/4885

“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.