SCHEMBL18447090

SCHEMBL18447090

O=C(Cc1ccccc1)Nc1cncc(-c2cc3c(-c4cc5ccncc5[nH]4)n[nH]c3cn2)c1

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ WNT1 P04628 6/20 0.70
▸ TGFBR1 P36897 3/20 0.70
▸ CLK2 P49760 14/20 0.69
▸ CLK3 P49761 14/20 0.69
▸ DYRK1A Q13627 14/20 0.69

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
SCHEMBL18440575 0.93 CLK2 (0.79) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL18443831 0.93 WNT1 (0.75) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL18440674 0.90 CLK2 (0.77) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL18448101 0.88 CLK2 (0.87) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL18447245 0.88 CLK2 (0.73) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL18446722 0.88 CLK2 (0.72) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL20452264 0.88 WNT1 (0.71) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL18442135 0.88 CLK2 (0.68) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL18451980 0.88 CLK2 (0.72) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL18447593 0.87 CLK2 (0.80) WNT1TGFBR1CLK2CLK3DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10383861-B2 3-(1H-pyrrolo[2,3-C]pyridin-2-yl)-1H-pyrazolo[3,4-C]pyridines and therapeutic uses thereof Sammumed, LLC (US) 2019-08-20 — — US claimed
US-20180221351-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINES AND THERAPEUTIC USES THEREOF MED-PATHWAYS II LIMITED (VG) 2018-08-09 — — US claimed
WO-2017023975-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC. (US) 2017-02-09 — — WO claimed
US-10383861-B2 3-(1H-pyrrolo[2,3-C]pyridin-2-yl)-1H-pyrazolo[3,4-C]pyridines and therapeutic uses thereof Sammumed, LLC (US) 2019-08-20 — — US disclosed
US-20180221351-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINES AND THERAPEUTIC USES THEREOF MED-PATHWAYS II LIMITED (VG) 2018-08-09 — — US disclosed
US-20180221351-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINES AND THERAPEUTIC USES THEREOF MED-PATHWAYS II LIMITED (VG) 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 (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-10383861-B2 3-(1H-pyrrolo[2,3-C]pyridin-2-yl)-1H-pyrazolo[3,4-C]pyridines and therapeutic uses thereof WNT3, WNT1, WNT3A WNT1 2/4885TGFBR1 810/4885CLK2 2035/4885
US-20180221351-A1 3-(1H-PYRROLO[2,3-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINES AND THERAPEUTIC USES THEREOF WNT3, WNT1, WNT3A WNT1 2/4885TGFBR1 810/4885CLK2 2035/4885

“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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