SCHEMBL12397474

SCHEMBL12397474

CCC(=O)Nc1ccc(-c2cnc3[nH]nc(-c4nc5c(C(N)=O)ccnc5[nH]4)c3c2)cn1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.43
DHODH Q02127 1/20 0.43
CLK2 P49760 8/20 0.42
CLK3 P49761 8/20 0.42
DYRK1A Q13627 8/20 0.42
WNT1 P04628 7/20 0.39
CCNT1 O60563 1/20 0.38
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
CDK9 P50750 1/20 0.38
TGFBR1 P36897 1/20 0.38
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
PIK3CD O00329 1/20 0.36

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
SCHEMBL12396270 0.91 CLK2 (0.41) CLK2CLK3DYRK1AWNT1CCNT1
SCHEMBL12396644 0.90 CLK2 (0.41) CLK2CLK3DYRK1AWNT1CCNT1
SCHEMBL12397393 0.90 CLK2 (0.40) CLK2CLK3DYRK1AWNT1CCNT1
SCHEMBL12396291 0.88 PARP1 (0.59) PARP1DHODHCLK2CLK3DYRK1A
SCHEMBL12370040 0.88 CLK2 (0.53) CLK2CLK3DYRK1AWNT1TGFBR1
SCHEMBL12395513 0.88 CLK2 (0.41) CLK2CLK3DYRK1AWNT1CCNT1
SCHEMBL12396267 0.87 WNT1 (0.44) CLK2CLK3DYRK1AWNT1TGFBR1
SCHEMBL12395397 0.87 CLK2 (0.50) PARP1DHODHCLK2CLK3DYRK1A
SCHEMBL20041256 0.87 CLK2 (0.42) CLK2CLK3DYRK1AWNT1CCNT1
SCHEMBL12395407 0.86 WNT1 (0.47) CLK2CLK3DYRK1AWNT1TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-9446035-B2 1H-pyrazolo[3,4-b]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2016-09-20 US disclosed
US-20160101092-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI (PLAN) PTE. LTD. (SG) 2016-04-14 US disclosed
US-20160101092-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI (PLAN) PTE. LTD. (SG) 2016-04-14 US 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 (7 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 PARP1 74/4885DHODH 905/4885CLK2 2380/4885
US-20130225576-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK PARP1 74/4885DHODH 905/4885CLK2 2380/4885
US-20150045360-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK PARP1 74/4885DHODH 905/4885CLK2 2380/4885
US-20140323479-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK PARP1 74/4885DHODH 905/4885CLK2 2380/4885
US-20160101092-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK PARP1 74/4885DHODH 905/4885CLK2 2380/4885
US-20170202846-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK PARP1 74/4885DHODH 905/4885CLK2 2380/4885
US-20130296307-A1 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF BRCA1, THPO, PDXK PARP1 74/4885DHODH 905/4885CLK2 2380/4885

“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.