SCHEMBL986256

SCHEMBL986256

O=C(Nc1cccnc1Cl)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.81

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.65
SMN1; SMN2 Q16637 2/20 0.65
NPC1 O15118 2/20 0.65
RAB9A P51151 2/20 0.65
GAA P10253 1/20 0.58
NCOA1 Q15788 1/20 0.58
NCOA3 Q9Y6Q9 1/20 0.58
ATM Q13315 1/20 0.56
KCNMA1 Q12791 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
ALDH1A1 P00352 2/20 0.54
HPGD P15428 1/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 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
SCHEMBL26306456 0.86 HTT (0.64) HTTSMN1; SMN2NPC1RAB9AKCNMA1
SCHEMBL2507014 0.84 NPC1 (0.61) HTTSMN1; SMN2NPC1RAB9AATM
SCHEMBL30733199 0.82 MAPT (0.67) HTTSMN1; SMN2RAB9AGAANCOA1
SCHEMBL11995707 0.82 MAPT (0.67) HTTSMN1; SMN2RAB9AGAANCOA1
SCHEMBL16973835 0.82 CYP1A2 (0.59) HTTSMN1; SMN2NPC1RAB9AGAA
SCHEMBL394289 0.81 KCNMA1 (0.79) HTTSMN1; SMN2GAANCOA1NCOA3
SCHEMBL8299753 0.81 TDP1 (0.68) HTTSMN1; SMN2NPC1RAB9AGAA
SCHEMBL28358581 0.81 HTT (0.56) HTTSMN1; SMN2NPC1RAB9AGAA
SCHEMBL9867402 0.80 KDR (0.70) HTTSMN1; SMN2NPC1RAB9AGAA
SCHEMBL2506958 0.80 MEN1 (0.54) HTTSMN1; SMN2RAB9AGAANCOA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3704117-B1 AZABICYCLO DERIVATIVES FOR TREATING OCULAR DISORDERS ALCON INC (CH) 2026-01-28 EP disclosed
US-12247028-B2 Azabicyclo and diazepine derivatives ALCON INC. (CH) 2025-03-11 US disclosed
US-20240132497-A1 AZABICYCLO AND DIAZEPINE DERIVATIVES ALCON INC. (CH) 2024-04-25 US disclosed
US-11884666-B2 Azabicyclo and diazepine derivatives ALCON INC. (CH) 2024-01-30 US disclosed
US-20220267328-A1 AZABICYCLO AND DIAZEPINE DERIVATIVES ALCON INC. (CH) 2022-08-25 US disclosed
US-11306090-B2 Azabicyclo and diazepine derivatives ALCON INC. (CH) 2022-04-19 US disclosed
US-20210179616-A1 AZABICYCLO AND DIAZEPINE DERIVATIVES ALCON INC. (CH) 2021-06-17 US disclosed
US-20210179616-A1 AZABICYCLO AND DIAZEPINE DERIVATIVES ALCON INC. (CH) 2021-06-17 US disclosed
CN-111247147-A Azabicyclo and diazepatriene derivatives useful for treating ocular disorders 爱尔康公司 2020-06-05 CN disclosed
US-8492401-B2 Thiazolopyridine sirtuin modulating compounds GLAXOSMITHKLINE LLC (US) 2013-07-23 US disclosed
EP-2217606-A1 SOLUBILIZED THIAZOLOPYRIDINES Sirtris Pharmaceuticals, Inc. (US) 2010-08-18 EP disclosed
WO-2010071853-A1 THIAZOLOPYRIDINE SIRTUIN MODULATING COMPOUNDS SIRTRIS PHARMACEUTICALS, INC. (US) 2010-06-24 WO disclosed
WO-2009061453-A1 SOLUBILIZED THIAZOLOPYRIDINES SIRTRIS PHARMACEUTICALS, INC. (US) 2009-05-14 WO disclosed
WO-2009061453-A1 SOLUBILIZED THIAZOLOPYRIDINES SIRTRIS PHARMACEUTICALS, INC. (US) 2009-05-14 WO disclosed
US-20070265251-A1 Muscarinic Antagonists With Parp and Sir Modulating Activity as Cytoprotective Agents PROTEOSYS AG (DE) 2007-11-15 US disclosed
CN-101005845-A Muscarinic antagonists with PARP and SIR modulatng activity as agents for inflammatory diseases PROTEOSYS AG (DE) 2007-07-25 CN disclosed
EP-1768674-A1 MUSCARINIC ANTAGONISTS WITH PARP AND SIR MODULATING ACTIVITY AS CYTOPROTECTIVE AGENTS ProteoSys AG (DE) 2007-04-04 EP disclosed
WO-2006008118-A1 MUSCARINIC ANTAGONISTS WITH PARP AND SIR MODULATING ACTIVITY AS CYTOPROTECTIVE AGENTS PROTEOSYS AG (DE) 2006-01-26 WO disclosed
US-5077408-A PROCESS FOR THE SYNTHESIS OF OXAZOLOPYRIDINE COMPOUNDS SCIENCE ET ORGANISATION (FR) 1991-12-31 US disclosed
US-4308206-A Process for preparing derivatives of 5,11-dihydro-6h-pyrido[2,3-b][1,4]-benzodiazepin-6-one, and the final derivatives and synthesis intermediates obtained thereby MICROSULES ARGENTINA S.A. DE S.C.I.I.A. (AR) 1981-12-29 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-11884666-B2 Azabicyclo and diazepine derivatives CHRM3, CHRM5, CHRNA5 HTT 4056/4885SMN1; SMN2 4479/4885NPC1 1376/4885
US-20070265251-A1 Muscarinic Antagonists With Parp and Sir Modulating Activity as Cytoprotective Agents CHRM1, PARP1, CHRM2 HTT 1194/4885SMN1; SMN2 1498/4885NPC1 2893/4885
US-20240132497-A1 AZABICYCLO AND DIAZEPINE DERIVATIVES CHRM3, CHRM5, CHRNA5 HTT 4056/4885SMN1; SMN2 4479/4885NPC1 1376/4885
US-20210179616-A1 AZABICYCLO AND DIAZEPINE DERIVATIVES CHRM3, CHRM5, CHRNA5 HTT 4056/4885SMN1; SMN2 4479/4885NPC1 1376/4885
US-20220267328-A1 AZABICYCLO AND DIAZEPINE DERIVATIVES CHRM3, CHRM5, CHRNA5 HTT 4056/4885SMN1; SMN2 4479/4885NPC1 1376/4885
US-12247028-B2 Azabicyclo and diazepine derivatives CHRM3, CHRM5, CHRNA5 HTT 4056/4885SMN1; SMN2 4479/4885NPC1 1376/4885
US-11306090-B2 Azabicyclo and diazepine derivatives CHRM3, CHRM5, CHRNA5 HTT 4056/4885SMN1; SMN2 4479/4885NPC1 1376/4885

“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.