SCHEMBL18440901

SCHEMBL18440901

Cc1ccncc1-c1cc2c(-c3cc4c(-c5ccoc5)ccnc4[nH]3)n[nH]c2cn1

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ WNT1 P04628 10/20 0.75
▸ CLK2 P49760 9/20 0.62
▸ DYRK1A Q13627 9/20 0.62
▸ CLK3 P49761 6/20 0.62
▸ PIM1 P11309 1/20 0.50
▸ TGFBR1 P36897 1/20 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
SCHEMBL18440692 0.89 WNT1 (0.66) WNT1CLK2DYRK1ACLK3PIM1
SCHEMBL20965162 0.89 WNT1 (0.85) WNT1CLK2DYRK1ACLK3TGFBR1
SCHEMBL18443965 0.89 CLK2 (0.62) WNT1CLK2DYRK1ACLK3PIM1
SCHEMBL20398000 0.89 WNT1 (0.61) WNT1CLK2DYRK1ACLK3
SCHEMBL18446603 0.89 DYRK1A (0.64) WNT1CLK2DYRK1ACLK3PIM1
SCHEMBL18439773 0.88 CLK2 (0.68) WNT1CLK2DYRK1ACLK3PIM1
SCHEMBL18440888 0.87 WNT1 (0.62) WNT1CLK2DYRK1ACLK3PIM1
SCHEMBL18440995 0.87 CLK2 (0.77) WNT1CLK2DYRK1ACLK3PIM1
SCHEMBL18441039 0.87 WNT1 (0.78) WNT1CLK2DYRK1ACLK3
SCHEMBL18448688 0.86 CLK2 (0.81) WNT1CLK2DYRK1ACLK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10285982-B2 3-(1H-pyrrolo[2,3-B]pyridin-2-yl)-1H-pyrazolo[3,4-C]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2019-05-14 — — US claimed
WO-2017023980-A1 3-(1H-PYRROLO[2,3-B]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC. (US) 2017-02-09 — — WO claimed
US-10285982-B2 3-(1H-pyrrolo[2,3-B]pyridin-2-yl)-1H-pyrazolo[3,4-C]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-10285982-B2 3-(1H-pyrrolo[2,3-B]pyridin-2-yl)-1H-pyrazolo[3,4-C]pyridines and therapeutic uses thereof WNT1, WNT3, WNT3A WNT1 1/4885CLK2 2095/4885DYRK1A 806/4885

“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.

Send feedback