SCHEMBL17567702

SCHEMBL17567702

c1csc(-c2nccc3[nH]c(-c4n[nH]c5cnc(-c6cncnc6)cc45)nc23)c1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CLK2 P49760 7/20 0.68
CLK3 P49761 7/20 0.68
DYRK1A Q13627 7/20 0.68
WNT1 P04628 13/20 0.61
TGFBR1 P36897 12/20 0.59
PIM1 P11309 1/20 0.53

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
SCHEMBL17568453 0.92 CLK2 (0.68) CLK2CLK3DYRK1AWNT1TGFBR1
SCHEMBL17567701 0.92 CLK2 (0.79) CLK2CLK3DYRK1AWNT1TGFBR1
SCHEMBL17567677 0.89 CLK2 (0.77) CLK2CLK3DYRK1AWNT1TGFBR1
SCHEMBL17568447 0.89 CLK2 (0.71) CLK2CLK3DYRK1AWNT1TGFBR1
SCHEMBL17566064 0.88 WNT1 (0.78) CLK2CLK3DYRK1AWNT1TGFBR1
SCHEMBL17556650 0.88 WNT1 (0.80) CLK2CLK3DYRK1AWNT1TGFBR1
SCHEMBL17587123 0.88 DYRK1A (0.59) CLK2CLK3DYRK1AWNT1
SCHEMBL20454107 0.87 CLK2 (0.63) CLK2CLK3DYRK1A
SCHEMBL17568416 0.87 CLK2 (0.62) CLK2CLK3DYRK1AWNT1TGFBR1
SCHEMBL17568470 0.87 CLK2 (0.66) 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016040181-A1 3-(1H-IMIDAZO[4,5-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINE AND THERAPEUTIC USES THEREOF SAMUMED, LLC (US) 2016-03-17 WO claimed
US-9844536-B2 3-(1H-imidazo[4,5-C]pyridin-2-yl)-1H-pyrazolo[3,4-C]pyridine and therapeutic uses thereof SAMUMED, LLC (US) 2017-12-19 US disclosed
US-9844536-B2 3-(1H-imidazo[4,5-C]pyridin-2-yl)-1H-pyrazolo[3,4-C]pyridine and therapeutic uses thereof SAMUMED, LLC (US) 2017-12-19 US disclosed
US-20170267697-A1 3-(1H-IMIDAZO[4,5-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINE AND THERAPEUTIC USES THEREOF VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2017-09-21 US disclosed
US-20170267697-A1 3-(1H-IMIDAZO[4,5-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINE AND THERAPEUTIC USES THEREOF VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2017-09-21 US disclosed
US-9540398-B2 3-(1h-imidazo[4,5-C]pyridin-2-yl)-1h-pyrazolo[3,4-C]pyridine and therapeutic uses thereof SAMUMED, LLC (US) 2017-01-10 US disclosed
US-9540398-B2 3-(1h-imidazo[4,5-C]pyridin-2-yl)-1h-pyrazolo[3,4-C]pyridine and therapeutic uses thereof SAMUMED, LLC (US) 2017-01-10 US disclosed
US-20160068547-A1 3-(1H-IMIDAZO[4,5-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINE AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI (PLAN) PTE. LTD. (SG) 2016-03-10 US disclosed
US-20160068547-A1 3-(1H-IMIDAZO[4,5-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINE AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI (PLAN) PTE. LTD. (SG) 2016-03-10 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-20160068547-A1 3-(1H-IMIDAZO[4,5-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINE AND THERAPEUTIC USES THEREOF WNT1, WNT3, WNT3A CLK2 2251/4885CLK3 1922/4885DYRK1A 966/4885
US-20170267697-A1 3-(1H-IMIDAZO[4,5-C]PYRIDIN-2-YL)-1H-PYRAZOLO[3,4-C]PYRIDINE AND THERAPEUTIC USES THEREOF WNT1, WNT3, WNT3A CLK2 2251/4885CLK3 1922/4885DYRK1A 966/4885

“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.