SCHEMBL5786049

SCHEMBL5786049

Cc1ccn2c(-c3ccnc(-c4ccc(O)cc4)c3)c(-c3cccc(C)n3)nc2c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ USP7 Q93009 1/20 0.48
▸ TGFBR1 P36897 16/20 0.45
▸ KDR P35968 8/20 0.45
▸ MAPK14 Q16539 6/20 0.45
▸ GAA P10253 3/20 0.41
▸ HTT P42858 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ NPSR1 Q6W5P4 3/20 0.41
▸ TDP1 Q9NUW8 3/20 0.41
▸ MITF O75030 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ TP53 P04637 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
SCHEMBL5792573 0.89 TGFBR1 (0.45) USP7TGFBR1KDRMAPK14
SCHEMBL5788266 0.87 TGFBR1 (0.43) TGFBR1KDRMAPK14GAAHTT
SCHEMBL6335287 0.84 GAA (0.49) TGFBR1KDRMAPK14GAASMN1; SMN2
SCHEMBL5786499 0.84 BACE1 (0.40) TGFBR1KDRMAPK14GAAHTT
SCHEMBL5790085 0.84 TGFBR1 (0.46) TGFBR1KDRMAPK14MAPT
SCHEMBL5787113 0.83 GAA (0.41) TGFBR1KDRMAPK14GAAHTT
SCHEMBL5790048 0.82 TGFBR1 (0.38) TGFBR1KDRMAPK14MAPT
SCHEMBL5788683 0.82 USP7 (0.48) USP7TGFBR1KDRMAPK14GAA
SCHEMBL5791728 0.81 SMN1; SMN2 (0.49) TGFBR1KDRMAPK14GAASMN1; SMN2
SCHEMBL5788026 0.81 HRH3 (0.49) TGFBR1

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 USP7 4477/4885TGFBR1 4/4885KDR 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.

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