SCHEMBL5789274

SCHEMBL5789274

Cc1cccc(-c2nc3c(C)cccn3c2-c2ccnc(-c3ccc(CN4CCOCC4)cc3)c2)n1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 13/20 0.46
MAPKAPK2 P49137 1/20 0.41
KDR P35968 7/20 0.41
DYRK1A Q13627 1/20 0.40
KDM1A O60341 1/20 0.40
MAPK14 Q16539 3/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TNKS O95271 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL5790966 0.92 TGFBR1 (0.44) TGFBR1KDRMAPK14GAAMAPT
SCHEMBL5789640 0.87 TGFBR1 (0.49) TGFBR1MAPKAPK2KDRMAPK14JAK2
SCHEMBL5791728 0.85 SMN1; SMN2 (0.49) TGFBR1MAPKAPK2KDRDYRK1AMAPK14
SCHEMBL5789395 0.84 TGFBR1 (0.48) TGFBR1KDRMAPK14JAK2JAK1
SCHEMBL5791430 0.83 SLC2A1 (0.50) TGFBR1
SCHEMBL5788683 0.81 USP7 (0.48) TGFBR1KDRMAPK14GAAMAPT
SCHEMBL5789604 0.79 TGFBR1 (0.43) TGFBR1KDRMAPK14GAAMAPT
SCHEMBL5907467 0.78 TGFBR1 (0.54) TGFBR1MAPKAPK2KDRDYRK1AMAPK14
SCHEMBL5791586 0.78 TGFBR1 (0.59) TGFBR1KDRMAPK14GAAMAPT
SCHEMBL5907462 0.78 TGFBR1 (0.55) TGFBR1MAPKAPK2KDRDYRK1AMAPK14

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 TGFBR1 4/4885MAPKAPK2 81/4885KDR 160/4885

“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.