SCHEMBL2274785

SCHEMBL2274785

c1ccc2[nH]c(-c3n[nH]c4ncccc34)cc2c1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ITK Q08881 18/20 0.68
▸ CLK2 P49760 1/20 0.50
▸ CLK3 P49761 1/20 0.50
▸ DYRK1A Q13627 1/20 0.50
▸ CYP19A1 P11511 1/20 0.49

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
SCHEMBL29714858 1.00 ITK (0.68) ITKCLK2CLK3DYRK1ACYP19A1
SCHEMBL18426816 0.87 CLK2 (0.60) ITKCLK2CLK3DYRK1A
SCHEMBL29714863 0.86 CLK3 (0.54) ITKCLK2CLK3DYRK1A
SCHEMBL29714867 0.86 CLK2 (0.63) ITKCLK2CLK3DYRK1A
SCHEMBL18426533 0.86 CLK3 (0.54) ITKCLK2CLK3DYRK1A
SCHEMBL18426815 0.86 CLK2 (0.63) ITKCLK2CLK3DYRK1A
SCHEMBL18453110 0.84 ITK (0.47) ITKCLK2CLK3DYRK1A
SCHEMBL29714876 0.83 ITK (0.68) ITKCLK2CLK3DYRK1A
SCHEMBL18426971 0.83 ITK (0.68) ITKCLK2CLK3DYRK1A
SCHEMBL145584 0.82 ITK (1.00) ITK

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240197523-A1 MOTORIZED INJECTION SYSTEM AND METHODS OF USE MEIRAGTX UK II LIMITED (GB) 2024-06-20 — — US disclosed
CN-114728132-A Injection system and method of use 梅拉格特克斯治疗学股份有限公司 2022-07-08 — — CN disclosed
US-10105370-B2 1H-pyrazolo[3,4-B]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2018-10-23 — — US disclosed
US-20180256588-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI (PLAN) PTE. LTD. (SG) 2018-09-13 — — US disclosed
US-20180214428-A1 3-(1H-INDOL-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC 2018-08-02 — — US disclosed
US-20180214428-A1 3-(1H-INDOL-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC 2018-08-02 — — US disclosed
EP-3305073-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF Samumed, LLC (US) 2018-04-11 — — EP disclosed
US-9855272-B2 1H-pyrazolo[3,4-B]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2018-01-02 — — US disclosed
US-20170202846-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI PTE. LTD. (SG) 2017-07-20 — — US disclosed
WO-2017023973-A1 3-(1H-INDOL-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC. (US) 2017-02-09 — — WO disclosed
US-9067939-B2 1H-pyrazolo[3,4-b]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2015-06-30 — — US disclosed
US-20150045360-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI (PLAN) PTE. LTD. (SG) 2015-02-12 — — US disclosed
US-8901150-B2 1H-pyrazolo[3,4-B]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2014-12-02 — — US disclosed
US-20140323479-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2014-10-30 — — US disclosed
US-8846714-B2 1H-pyrazolo[3,4-β]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2014-09-30 — — US disclosed
US-8815897-B2 1H-pyrazolo[3,4-B]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2014-08-26 — — US disclosed
US-20130296307-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI PTE. LTD. (SG) 2013-11-07 — — US disclosed
US-20130225576-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC (US) 2013-08-29 — — US disclosed
US-8450340-B2 1H-pyrazolo[3,4-b]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2013-05-28 — — US disclosed
US-20110190290-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF EPITHERIX, LLC (US) 2011-08-04 — — 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 (9 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-20110190290-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK ITK 1527/4885CLK2 2380/4885CLK3 2177/4885
US-20130225576-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK ITK 1527/4885CLK2 2380/4885CLK3 2177/4885
US-20150045360-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK ITK 1527/4885CLK2 2380/4885CLK3 2177/4885
US-20140323479-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK ITK 1527/4885CLK2 2380/4885CLK3 2177/4885
US-20170202846-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK ITK 1527/4885CLK2 2380/4885CLK3 2177/4885
US-10105370-B2 1H-pyrazolo[3,4-B]pyridines and therapeutic uses thereof BRCA1, THPO, PDXK ITK 1527/4885CLK2 2380/4885CLK3 2177/4885
US-20180214428-A1 3-(1H-INDOL-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF WNT1, WNT3, WNT3A ITK 1674/4885CLK2 1502/4885CLK3 1500/4885
US-20180256588-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK ITK 1527/4885CLK2 2380/4885CLK3 2177/4885
US-20130296307-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK ITK 1527/4885CLK2 2380/4885CLK3 2177/4885

“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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