SCHEMBL18451983

SCHEMBL18451983

Fc1ccc(-c2cncc3[nH]c(-c4n[nH]c5ncc(-c6cncc(OCc7ccccc7)c6)cc45)cc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 18/20 0.49
CLK3 P49761 17/20 0.49
CLK2 P49760 17/20 0.49
WNT1 P04628 2/20 0.45

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
SCHEMBL20453225 0.93 CLK3 (0.56) DYRK1ACLK3CLK2WNT1
SCHEMBL18453964 0.93 WNT1 (0.50) DYRK1ACLK3CLK2WNT1
SCHEMBL18451513 0.92 DYRK1A (0.52) DYRK1ACLK3CLK2WNT1
SCHEMBL18448446 0.91 CLK3 (0.57) DYRK1ACLK3CLK2WNT1
SCHEMBL18452018 0.90 CLK3 (0.48) DYRK1ACLK3CLK2WNT1
SCHEMBL18451583 0.90 DYRK1A (0.52) DYRK1ACLK3CLK2WNT1
SCHEMBL20463537 0.90 CLK3 (0.49) DYRK1ACLK3CLK2WNT1
SCHEMBL18484303 0.90 CLK3 (0.49) DYRK1ACLK3CLK2WNT1
SCHEMBL20463468 0.89 CLK3 (0.57) DYRK1ACLK3CLK2WNT1
SCHEMBL20451843 0.88 CLK2 (0.57) DYRK1ACLK3CLK2WNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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 claimed
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

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 DYRK1A 896/4885CLK3 2160/4885CLK2 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.