SCHEMBL18442500

SCHEMBL18442500

Cc1ccncc1-c1ccc2[nH]nc(-c3cc4c(-c5ccoc5)cncc4[nH]3)c2n1

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 20/20 0.78
CLK2 P49760 19/20 0.78
CLK3 P49761 19/20 0.78

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
SCHEMBL18445267 0.91 CLK2 (0.68) DYRK1ACLK2CLK3
SCHEMBL18442519 0.90 DYRK1A (0.62) DYRK1ACLK2CLK3
SCHEMBL18442367 0.90 DYRK1A (0.85) DYRK1ACLK2CLK3
SCHEMBL18449951 0.89 CLK2 (0.66) DYRK1ACLK2CLK3
SCHEMBL18448688 0.88 CLK2 (0.81) DYRK1ACLK2CLK3
SCHEMBL18442017 0.88 CLK3 (0.71) DYRK1ACLK2CLK3
SCHEMBL18441933 0.88 DYRK1A (1.00) DYRK1ACLK2CLK3
SCHEMBL20591806 0.87 CLK2 (0.60) DYRK1ACLK2CLK3
SCHEMBL18442419 0.87 DYRK1A (0.58) DYRK1ACLK2CLK3
SCHEMBL18442168 0.86 DYRK1A (0.80) DYRK1ACLK2CLK3

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-20180370989-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[4,3-B]PYRIDINES AND THERAPEUTIC USES THEREOF MED-PATHWAYS II LIMITED (VG) 2018-12-27 US claimed
WO-2017024025-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[4,3-B]PYRIDINES AND THERAPEUTIC USES THEREOF KC SUNIL KUMAR (US) 2017-02-09 WO claimed

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-20180370989-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[4,3-B]PYRIDINES AND THERAPEUTIC USES THEREOF WNT1, WNT3, WNT3A DYRK1A 823/4885CLK2 2162/4885CLK3 2201/4885

“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.