SCHEMBL5789395

SCHEMBL5789395

Cc1cccc(-c2nc3c(C)cccn3c2-c2ccnc(-c3ccc(C(=O)N4CCOCC4)cc3)c2)n1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 11/20 0.48
KDR P35968 7/20 0.48
MAPK14 Q16539 3/20 0.46
HPGD P15428 1/20 0.44
ABL1 P00519 4/20 0.43
BCR P11274 4/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40
JAK3 P52333 1/20 0.40

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
SCHEMBL5787306 0.89 TGFBR1 (0.45) TGFBR1KDRMAPK14ABL1BCR
SCHEMBL5787871 0.88 TGFBR1 (0.50) TGFBR1KDRMAPK14HPGDABL1
SCHEMBL5789274 0.84 TGFBR1 (0.46) TGFBR1KDRMAPK14JAK2JAK1
SCHEMBL5788683 0.82 USP7 (0.48) TGFBR1KDRMAPK14
SCHEMBL5789604 0.79 TGFBR1 (0.43) TGFBR1KDRMAPK14
SCHEMBL5791586 0.79 TGFBR1 (0.59) TGFBR1KDRMAPK14
SCHEMBL5907496 0.78 TGFBR1 (0.56) TGFBR1KDRMAPK14HPGDABL1
SCHEMBL5802786 0.78 TGFBR1 (0.50) TGFBR1HPGDABL1BCRMKNK1
SCHEMBL5790314 0.78 TGFBR1 (0.46) TGFBR1KDRMAPK14
SCHEMBL5790966 0.77 TGFBR1 (0.44) TGFBR1KDRMAPK14

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 4/4885KDR 160/4885MAPK14 285/4885

“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.