SCHEMBL18426533

SCHEMBL18426533

c1cnc2[nH]nc(-c3cc4ccncc4[nH]3)c2c1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CLK3 P49761 11/20 0.54
▸ DYRK1A Q13627 11/20 0.54
▸ CLK2 P49760 10/20 0.54
▸ ITK Q08881 9/20 0.50

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
SCHEMBL29714863 1.00 CLK3 (0.54) CLK3DYRK1ACLK2ITK
SCHEMBL29714867 0.89 CLK2 (0.63) CLK3DYRK1ACLK2ITK
SCHEMBL18426815 0.89 CLK2 (0.63) CLK3DYRK1ACLK2ITK
SCHEMBL2274785 0.86 ITK (0.68) CLK3DYRK1ACLK2ITK
SCHEMBL29714858 0.86 ITK (0.68) CLK3DYRK1ACLK2ITK
SCHEMBL16456187 0.84 CLK3 (0.60) CLK3DYRK1ACLK2
SCHEMBL18426827 0.83 ITK (0.73) CLK3DYRK1ACLK2ITK
SCHEMBL18484423 0.82 CLK2 (0.51) CLK3DYRK1ACLK2ITK
SCHEMBL20452886 0.82 DYRK1A (0.56) CLK3DYRK1ACLK2ITK
SCHEMBL18426816 0.81 CLK2 (0.60) CLK3DYRK1ACLK2ITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240197523-A1 MOTORIZED INJECTION SYSTEM AND METHODS OF USE MEIRAGTX UK II LIMITED (GB) 2024-06-20 — — US disclosed
US-20180221352-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC 2018-08-09 — — US disclosed
US-20180221352-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC 2018-08-09 — — US disclosed
WO-2017023981-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC. (US) 2017-02-09 — — WO disclosed
WO-2017023981-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC. (US) 2017-02-09 — — 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 (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-20180221352-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF WNT1, WNT3A, WNT3 CLK3 2160/4885DYRK1A 896/4885CLK2 2019/4885

“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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