SCHEMBL5057521

SCHEMBL5057521

CCNc1nc(NC)ncc1CO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 2/20 0.38
▸ PDXK O00764 1/20 0.35
▸ PGK1 P00558 2/20 0.34
▸ AGTR1 P30556 3/20 0.34
▸ AGTR2 P50052 3/20 0.34
▸ HTT P42858 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ BCHE P06276 2/20 0.32
▸ ACHE P22303 2/20 0.32
▸ USP2 O75604 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ GLA P06280 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ FLT3 P36888 1/20 0.32
▸ LRRK2 Q5S007 1/20 0.32

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
SCHEMBL4713441 0.79 AURKA (0.51) AURKAHTTFLT3LRRK2
SCHEMBL14809680 0.78 PGK1 (0.39) PDXKPGK1AGTR1AGTR2HTT
SCHEMBL4405613 0.76 MERTK (0.49) FLT3MERTK
SCHEMBL1521623 0.75 HTT (0.55) PGK1AGTR1AGTR2HTTALDH1A1
SCHEMBL12409766 0.72 LRRK2 (0.55) CYP1A2LRRK2
SCHEMBL14410940 0.72 PDXK (0.32) PDXKAGTR1AGTR2HTT
SCHEMBL15624865 0.68 AGTR1 (0.41) PDXKAGTR1AGTR2ALDH1A1HPGD
SCHEMBL14810588 0.67 YTHDC1 (0.40) PDXKALDH1A1HPGDHSD17B10KDM4E
SCHEMBL11916193 0.67 CYP1A2 (0.42) AURKAPGK1ALDH1A1HPGDHSD17B10
SCHEMBL18181689 0.66 AURKA (0.46) AURKAFLT3LRRK2

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
US-8188113-B2 For example, 1-(5-(2-amino-8-methyl-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-6-yl)-2-fluorophenyl)-3-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)urea; for treatment of mammalian cancers and inflammatory diseases including rheumatoid arthritis, retinopathies DECIPHERA PHARMACEUTICALS, INC. (US) 2012-05-29 — — US disclosed
US-20080114006-A1 Kinase inhibitors useful for the treatment of proliferative diseases DECIPHERA PARMACEUTICALS, LLC (US) 2008-05-15 — — 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-20080114006-A1 Kinase inhibitors useful for the treatment of proliferative diseases BRAF, PRKDC, RAF1 AURKA 303/4885PDXK 130/4885PGK1 469/4885

“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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