SCHEMBL4286311

SCHEMBL4286311

COc1cc(-c2ccccc2Cl)c2c(c1)N(c1ccccc1Cl)C(=O)CC2

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.59
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
HCRTR1 O43613 1/20 0.40
GAA P10253 1/20 0.40
XDH P47989 1/20 0.38
USP2 O75604 1/20 0.38
ESR1 P03372 1/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.38
NR4A1 P22736 1/20 0.38
DNMT1 P26358 1/20 0.38
PTPN7 P35236 1/20 0.38
RECQL P46063 1/20 0.38
DUSP3 P51452 1/20 0.38
PTPN5 P54829 1/20 0.38
PTPN11 Q06124 1/20 0.38
ESR2 Q92731 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL6667920 0.89 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11
SCHEMBL4068301 0.86 MAPK14 (0.46) MAPK14KMT2AMEN1HCRTR1GAA
SCHEMBL6668069 0.82 MAPK14 (0.52) MAPK14KMT2A
SCHEMBL6669483 0.78 MAPK14 (0.62) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6670053 0.75 MAPK14 (0.74) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6669680 0.74 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6669149 0.74 MAPK14 (0.62) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6670174 0.74 MAPK14 (0.54) MAPK14KMT2AMEN1GAAPOLB
SCHEMBL4299779 0.73 MEN1 (0.41) MAPK14KMT2AMEN1MAPTHSD17B10
SCHEMBL6672641 0.73 MAPK14 (0.79) MAPK14MAPK13MAPK12MAPK11

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-20090239897-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2009-09-24 US disclosed
US-20090239897-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2009-09-24 US disclosed
US-20090239897-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2009-09-24 US disclosed
US-7550480-B2 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-06-23 US disclosed
US-7550480-B2 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-06-23 US disclosed
US-7550480-B2 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-06-23 US disclosed
US-20060211727-A1 Novel compounds GLAXOSMITHKLINE LLC 2006-09-21 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-20090239897-A1 NOVEL COMPOUNDS MAPKAPK2, CREBBP, MAPK1 MAPK14 32/4885KMT2A 3531/4885MEN1 4788/4885
US-20060211727-A1 Novel compounds MAPKAPK2, CREBBP, MAPK1 MAPK14 32/4885KMT2A 3531/4885MEN1 4788/4885

“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.