SCHEMBL20928277

SCHEMBL20928277

COC1CC(OC(=O)N2CCN(c3ccnc4[nH]c(-c5cnn(C)c5)cc34)CC2)C1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 13/20 0.46
▸ CLK2 P49760 4/20 0.40
▸ DYRK1A Q13627 4/20 0.40
▸ TBK1 Q9UHD2 1/20 0.40
▸ AURKA O14965 1/20 0.40
▸ AURKB Q96GD4 1/20 0.40
▸ INCENP Q9NQS7 1/20 0.40
▸ TPX2 Q9ULW0 1/20 0.40
▸ CCNA2 P20248 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ TTK P33981 1/20 0.39
▸ CLK3 P49761 3/20 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
SCHEMBL20927825 1.00 KIT (0.46) KITCLK2DYRK1ATBK1AURKA
SCHEMBL22568740 0.92 KIT (0.46) KITCLK2DYRK1ATBK1AURKA
SCHEMBL20927822 0.92 KIT (0.47) KITCLK2DYRK1ATBK1AURKA
SCHEMBL22568666 0.92 KIT (0.47) KITCLK2DYRK1ATBK1AURKA
SCHEMBL20928384 0.91 KIT (0.50) KITCLK2DYRK1ATBK1AURKA
SCHEMBL22568802 0.90 KIT (0.44) KITCLK2DYRK1ATBK1AURKA
SCHEMBL20928163 0.90 KIT (0.44) KITCLK2DYRK1ATBK1AURKA
SCHEMBL22568713 0.90 KIT (0.49) KITCLK2DYRK1ATBK1AURKA
SCHEMBL22568644 0.89 KIT (0.46) KITCLK2DYRK1ATBK1AURKA
SCHEMBL20928145 0.88 KIT (0.51) KITCLK2DYRK1AAURKAAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11236086-B2 Substituted pyrrolopyridines as inhibitors of activin receptor-like kinase BLUEPRINT MEDICINES CORPORATION (US) 2022-02-01 — — US disclosed
US-20200331908-A1 SUBSTITUTED PYRROLOPYRIDINES AS INHIBITORS OF ACTIVIN RECEPTOR-LIKE KINASE BLUEPRINT MEDICINES CORPORATION 2020-10-22 — — US disclosed
WO-2019079649-A1 SUBSTITUTED PYRROLOPYRIDINES AS INHIBITORS OF ACTIVIN RECEPTOR-LIKE KINASE BLUEPRINT MEDICINES CORPORATION (US) 2019-04-25 — — WO 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 (2 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-11236086-B2 Substituted pyrrolopyridines as inhibitors of activin receptor-like kinase ALK, ACVR1, ACVR2A KIT 318/4885CLK2 787/4885DYRK1A 1161/4885
US-20200331908-A1 SUBSTITUTED PYRROLOPYRIDINES AS INHIBITORS OF ACTIVIN RECEPTOR-LIKE KINASE ALK, ACVR1, ACVR2A KIT 318/4885CLK2 787/4885DYRK1A 1161/4885

“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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