6-Nitroquipazine

6-Nitroquipazine

SCHEMBL401156

O=[N+]([O-])c1ccc2nc(N3CCNCC3)ccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 1.00
HTR3E A5X5Y0 1/20 1.00
HTR3B O95264 1/20 1.00
CYP1A2 P05177 1/20 1.00
CYP3A4 P08684 1/20 1.00
SLC6A4 P31645 1/20 1.00
CYP2C19 P33261 1/20 1.00
THPO P40225 1/20 1.00
HTR3A P46098 1/20 1.00
HTR3D Q70Z44 1/20 1.00
HTR3C Q8WXA8 1/20 1.00
LMNA P02545 1/20 0.82
PMP22 Q01453 1/20 0.82
NPSR1 Q6W5P4 1/20 0.82

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
SCHEMBL31060742 0.95 ALDH1A1 (0.90) ALDH1A1HTR3EHTR3BCYP1A2CYP3A4
6-Nitroquipazine SCHEMBL4266383 0.91 ALDH1A1 (1.00) ALDH1A1HTR3EHTR3BCYP1A2CYP3A4
6-Nitroquipazine SCHEMBL4266389 0.91 ALDH1A1 (1.00) ALDH1A1HTR3EHTR3BCYP1A2CYP3A4
6-Nitroquipazine SCHEMBL4266387 0.91 ALDH1A1 (1.00) ALDH1A1HTR3EHTR3BCYP1A2CYP3A4
SCHEMBL5873582 0.86 ALDH1A1 (0.76) ALDH1A1HTR3EHTR3BCYP1A2CYP3A4
SCHEMBL3559642 0.84 ALDH1A1 (0.72) ALDH1A1HTR3EHTR3BCYP1A2CYP3A4
SCHEMBL6421125 0.84 ALDH1A1 (0.72) ALDH1A1HTR3EHTR3BCYP1A2CYP3A4
SCHEMBL6365197 0.83 ALDH1A1 (0.70) ALDH1A1HTR3EHTR3BCYP1A2CYP3A4
SCHEMBL13666128 0.82 ALDH1A1 (0.69) ALDH1A1HTR3EHTR3BCYP1A2CYP3A4
SCHEMBL31373520 0.82 ALDH1A1 (0.69) ALDH1A1HTR3EHTR3BCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105636438-A Pharmaceutical composition comprising an AMPK activator and a serotonin active agent and uses thereof CHEN JIANHONG 2016-06-01 CN claimed
EP-2983473-A2 PHARMACEUTICAL COMPOSITION COMPRISING AN AMPK ACTIVATOR AND A SEROTONERGIC AGENT AND METHODS OF USE THEREOF ALS Mountain Llc (US) 2016-02-17 EP claimed
US-20140350064-A1 PHARMACEUTICAL COMPOSITION COMPRISING AN AMPK ACTIVATOR AND A SEROTONERGIC AGENT AND METHODS OF USE THEREOF ALS MOUNTAIN LLC 2014-11-27 US claimed
WO-2014144130-A2 PHARMACEUTICAL COMPOSITION COMPRISING AN AMPK ACTIVATOR AND A SEROTONERGIC AGENT AND METHODS OF USE THEREOF ALS MOUNTAIN LLC (US) 2014-09-18 WO claimed
US-20120183600-A1 NOVEL COMPOSITION FOR TREATING METABOLIC SYNDROME AND OTHER CONDITIONS CHEN CHIEN-HUNG (US) 2012-07-19 US claimed
EP-2111394-A1 COMPOUNDS WITH A COMBINATION OF CANNABINOID-CB1 ANTAGONISM AND SEROTONIN REUPTAKE INHIBITION Solvay Pharmaceuticals B.V. (NL) 2009-10-28 EP claimed
US-20080214559-A1 COMPOUNDS WITH A COMBINATION OF CANNABINOID CB1 ANTAGONISM AND SEROTONIN REUPTAKE INHIBITION SOLVAY PHARMACEUTICALS B.V. 2008-09-04 US claimed
WO-2008084057-A1 COMPOUNDS WITH A COMBINATION OF CANNABINOID-CB1 ANTAGONISM AND SEROTONIN REUPTAKE INHIBITION SOLVAY PHARMACEUTICALS B.V. (NL) 2008-07-17 WO claimed
EP-1435930-A2 ANTI-GLYCATION AGENTS FOR PREVENTING AGE-, DIABETES-, AND SMOKING-RELATED COMPLICATIONS NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2004-07-14 EP claimed
WO-2003082286-A1 QUINOLINE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME CHEMON INC. (KR) 2003-10-09 WO claimed
WO-2003032969-A2 ANTI-GLYCATION AGENTS FOR PREVENTING AGE-, DIABETES-, AND SMOKING-RELATED COMPLICATIONS NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2003-04-24 WO claimed
US-20020173511-A1 Serotonergic compositions and methods for treatment of mild cognitive impairment WURTMAN RICHARD J (US) 2002-11-21 US claimed
WO-2002038142-A2 SEROTONERGIC COMPOSITIONS AND METHODS FOR TREATMENT OF MILD COGNITIVE IMPAIRMENT MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2002-05-16 WO claimed
US-5372813-A Measurement of serotonin uptake sites in a sample using a radio labeled substituted 6-nitroquipazine as a radioligand THE REGENTS, UNIVERSITY OF CALIFORNIA (US) 1994-12-13 US claimed
US-5120641-A Incubating with sample, determining radioactivity DAIICHI PURE CHEMICALS CO., LTD. (JP) 1992-06-09 US claimed
EP-0435192-A2 Method for measurement of serotonin uptake sites and radioligand therefor DAIICHI PURE CHEMICALS CO. LTD. (JP) 1991-07-03 EP claimed
JP-3199969-A None JP disclosed
US-11246873-B2 Directed differentiation of oligodendrocyte precursor cells to a myelinating cell fate THE SCRIPPS RESEARCH INSTITUTE (US) 2022-02-15 US disclosed
US-4877788-A ANXIOLYTIC, ANTIAGGRESSIVE OR ANTIPSYCHOTIC AGENT ADIR ET CIE (FR) 1989-10-31 US disclosed
WO-1989003692-A1 TREATING PREMENSTRUAL OR LATE LUTEAL PHASE SYNDROME MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1989-05-05 WO 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 (1 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-20080214559-A1 COMPOUNDS WITH A COMBINATION OF CANNABINOID CB1 ANTAGONISM AND SEROTONIN REUPTAKE INHIBITION CNR1, OPRL1, CNR2 ALDH1A1 435/4885HTR3E 45/4885HTR3B 21/4885

“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.