SCHEMBL20965691

SCHEMBL20965691

O=C(Nc1cncc(-c2cnc3[nH]nc(-c4cc5c(-c6ccc(F)cc6)ccnc5[nH]4)c3c2)c1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CLK2 P49760 10/20 0.60
▸ DYRK1A Q13627 9/20 0.60
▸ CLK3 P49761 8/20 0.60
▸ WNT1 P04628 11/20 0.59

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
SCHEMBL18448584 0.93 CLK2 (0.67) CLK2DYRK1ACLK3WNT1
SCHEMBL18447600 0.93 CLK2 (0.63) CLK2DYRK1ACLK3WNT1
SCHEMBL18441607 0.92 CLK2 (0.71) CLK2DYRK1ACLK3WNT1
SCHEMBL20965888 0.92 CLK2 (0.68) CLK2DYRK1ACLK3WNT1
SCHEMBL20965853 0.91 CLK2 (0.56) CLK2DYRK1ACLK3WNT1
SCHEMBL20965998 0.91 WNT1 (0.62) CLK2DYRK1ACLK3WNT1
SCHEMBL18452889 0.89 CLK2 (0.60) CLK2DYRK1ACLK3WNT1
SCHEMBL20966172 0.89 WNT1 (0.62) CLK2DYRK1ACLK3WNT1
SCHEMBL20966101 0.88 WNT1 (0.65) CLK2DYRK1ACLK3WNT1
SCHEMBL20965699 0.88 CLK2 (0.56) CLK2DYRK1ACLK3WNT1

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-10285983-B2 3-(1H-pyrrolo[2,3-B]pyridin-2-yl)-1H-pyrazolo[3,4-B] pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2019-05-14 — — US claimed
US-10285983-B2 3-(1H-pyrrolo[2,3-B]pyridin-2-yl)-1H-pyrazolo[3,4-B] pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2019-05-14 — — 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-10285983-B2 3-(1H-pyrrolo[2,3-B]pyridin-2-yl)-1H-pyrazolo[3,4-B] pyridines and therapeutic uses thereof WNT1, WNT3A, WNT3 CLK2 2043/4885DYRK1A 849/4885CLK3 2290/4885

“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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