SCHEMBL5789751

SCHEMBL5789751

Oc1ccc(-c2cc(-c3c(-c4cccc(Cl)c4)nc4ccccn34)ccn2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 1/20 0.46
MAPK12 P53778 1/20 0.46
MAPK11 Q15759 1/20 0.46
MAPK14 Q16539 1/20 0.46
PIM1 P11309 1/20 0.44
USP7 Q93009 5/20 0.44
NR1I3 Q14994 7/20 0.42
IGF1R P08069 1/20 0.42
CDK2 P24941 1/20 0.42
NR1I2 O75469 2/20 0.41
TP53 P04637 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL5790886 0.84 USP7 (0.48) USP7NR1I3TP53GAAMAPT
SCHEMBL5790097 0.83 CDK2 (0.43) MAPK13MAPK12MAPK11MAPK14PIM1
SCHEMBL5788739 0.81 IGF1R (0.51) MAPK13MAPK12MAPK11MAPK14NR1I3
SCHEMBL5790032 0.81 GAA (0.46) MAPK13MAPK12MAPK11MAPK14NR1I3
SCHEMBL5792573 0.81 TGFBR1 (0.45) MAPK14PIM1USP7CDK2
SCHEMBL5789762 0.80 PRKAB2 (0.48)
SCHEMBL5792548 0.79 TGFBR1 (0.52) MAPK13MAPK12MAPK11MAPK14IGF1R
SCHEMBL25790036 0.76 NPC1 (0.56) NR1I3NR1I2TP53GAAMAPT
SCHEMBL5786829 0.75 NR1I3 (0.41) MAPK13MAPK12MAPK11MAPK14NR1I3
SCHEMBL5789074 0.73 IGF1R (0.43) MAPK13MAPK12MAPK11MAPK14NR1I3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1543003-B1 IMIDAZO¬1,2-A|PYRIDINES SMITHKLINE BEECHAM CORP (US) 2006-05-17 EP disclosed
US-20050234029-A1 Compounds DODIC NERINA 2005-10-20 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 (1 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-20050234029-A1 Compounds SMAD3, SMAD2, ACVR1 MAPK13 229/4885MAPK12 254/4885MAPK11 444/4885

“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.