SCHEMBL8792107

SCHEMBL8792107

COc1cccc(-c2nccc(N)c2[N+](=O)[O-])c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 1/20 0.46
▸ CLK4 Q9HAZ1 1/20 0.46
▸ NPC1 O15118 2/20 0.43
▸ CASP3 P42574 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ ADORA2A P29274 4/20 0.42
▸ LMNA P02545 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ ADORA1 P30542 3/20 0.42
▸ NPY1R P25929 1/20 0.42
▸ PIK3CG P48736 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ HPGD P15428 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ ADORA2B P29275 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL8793065 0.84 PDE3B (0.46) DYRK1ACLK4NPC1RAB9ALMNA
SCHEMBL27580682 0.82 ALDH1A1 (0.44) NPC1NPY1RCYP3A4GFERABCG2
SCHEMBL8793485 0.80 PDE4D (0.41) DYRK1ACLK4RAB9AADORA2AADORA1
SCHEMBL8792187 0.80 MGMT (0.42) ADORA2AADORA1ADORA2BKDM4EKMT2A
SCHEMBL4937390 0.80 RAB9A (0.46) DYRK1ACLK4NPC1CASP3RAB9A
SCHEMBL18448865 0.79 DYRK1A (0.54) DYRK1ACLK4ADORA2AADORA1PIK3CG
SCHEMBL30622627 0.79 DYRK1A (0.54) DYRK1ACLK4ADORA2AADORA1PIK3CG
SCHEMBL8662385 0.79 ABCC8 (0.43) LMNASMN1; SMN2NPY1RHPGDHTT
SCHEMBL18438030 0.79 RAB9A (0.49) NPC1CASP3RAB9ASENP7RECQL
SCHEMBL27354402 0.79 ALDH1A1 (0.47) CLK4LMNASMN1; SMN2PIK3CGMAOB

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-10195185-B2 3-(1H-imidazo[4,5-C]pyridin-2-yl)-1H-pyrazolo[4,3-B]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2019-02-05 — — US disclosed
US-20180221353-A1 3-(1H-IMIDAZO[4,5-C]PYRIDIN-2-YL)-1H-PYRAZOLO[4,3-B]PYRIDINES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI (PLAN) PTE. LTD. (SG) 2018-08-09 — — US disclosed
US-20180221353-A1 3-(1H-IMIDAZO[4,5-C]PYRIDIN-2-YL)-1H-PYRAZOLO[4,3-B]PYRIDINES AND THERAPEUTIC USES THEREOF VICKERS VENTURE FUND VI (PLAN) PTE. LTD. (SG) 2018-08-09 — — US disclosed
WO-2017023972-A1 3-(1H-IMIDAZO[4,5-C]PYRIDIN-2-YL)-1H-PYRAZOLO[4,3-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC. (US) 2017-02-09 — — WO disclosed
WO-2017023972-A1 3-(1H-IMIDAZO[4,5-C]PYRIDIN-2-YL)-1H-PYRAZOLO[4,3-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC. (US) 2017-02-09 — — WO disclosed
EP-0770079-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-02 — — EP 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-10195185-B2 3-(1H-imidazo[4,5-C]pyridin-2-yl)-1H-pyrazolo[4,3-B]pyridines and therapeutic uses thereof WNT1, WNT3, WNT3A DYRK1A 955/4885CLK4 2718/4885NPC1 3612/4885
US-20180221353-A1 3-(1H-IMIDAZO[4,5-C]PYRIDIN-2-YL)-1H-PYRAZOLO[4,3-B]PYRIDINES AND THERAPEUTIC USES THEREOF WNT1, WNT3, WNT3A DYRK1A 955/4885CLK4 2718/4885NPC1 3612/4885

“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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