SCHEMBL13220913

SCHEMBL13220913

Cc1cc(Nc2nc(Nc3ccc4c(=O)[nH][nH]c4c3)cc3nccn23)n[nH]1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 10/20 0.37
▸ AURKA O14965 5/20 0.35
▸ AURKB Q96GD4 5/20 0.35
▸ DHODH Q02127 1/20 0.35
▸ VRK1 Q99986 2/20 0.33
▸ ROCK2 O75116 1/20 0.33
▸ ITK Q08881 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
SCHEMBL13220909 0.84 SYK (0.38) SYKAURKAAURKB
SCHEMBL13054542 0.79 AURKA (0.45) SYKAURKAAURKBDHODHVRK1
SCHEMBL13220975 0.75 AURKA (0.54) SYKAURKAAURKB
SCHEMBL13054526 0.74 DOT1L (0.51) AURKAAURKB
SCHEMBL13054899 0.73 GSK3B (0.54) AURKAAURKB
SCHEMBL3037801 0.72 MEN1 (0.45) SYKAURKAAURKBITK
SCHEMBL13220976 0.72 AURKA (0.57) SYKAURKAAURKBITK
SCHEMBL5088387 0.71 CCNA2 (0.59) SYKAURKAAURKBITK
SCHEMBL13054535 0.71 PIK3C3 (0.42) AURKAAURKB
SCHEMBL13054528 0.71 AURKA (0.47) SYKAURKAAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8288536-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-16 — — US disclosed
US-8288536-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-16 — — US disclosed
US-20100216765-A1 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-26 — — US disclosed
US-20100216765-A1 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-26 — — US disclosed
US-7713973-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-11 — — US disclosed
US-7713973-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-11 — — 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-20100216765-A1 KINASE INHIBITORS MAP3K20, MAP3K19, MAP3K1 SYK 395/4885AURKA 161/4885AURKB 122/4885

“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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