Quinocide

Quinocide

SCHEMBL157174

COc1cc(NCCCC(C)N)c2ncccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 1.00
KMT2A Q03164 3/20 1.00
HSP90AA1 P07900 11/20 0.98
HSP90AB1 P08238 11/20 0.98
ALDH1A1 P00352 4/20 0.98
KDM4E B2RXH2 3/20 0.98
HTT P42858 2/20 0.98
THRB P10828 2/20 0.98
TDP2 O95551 1/20 0.98
FGB P02675 1/20 0.98
POLB P06746 1/20 0.98
GAA P10253 1/20 0.98
MAPT P10636 1/20 0.98
TSHR P16473 1/20 0.98
NR4A1 P22736 1/20 0.98
RECQL P46063 1/20 0.98
RAB9A P51151 1/20 0.98
BLM P54132 1/20 0.98
SMN1; SMN2 Q16637 1/20 0.98
TDP1 Q9NUW8 1/20 0.98

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
Quinocide SCHEMBL29720457 1.00 MEN1 (1.00) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Quinocide SCHEMBL28060369 0.99 HSP90AA1 (1.00) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Quinocide SCHEMBL30823571 0.99 HSP90AA1 (1.00) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Quinocide SCHEMBL707955 0.99 HSP90AA1 (1.00) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Quinocide SCHEMBL2286358 0.94 MEN1 (0.88) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
SCHEMBL17792862 0.85 HSP90AA1 (0.93) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
SCHEMBL8893299 0.84 HSP90AA1 (1.00) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Pentaquine SCHEMBL980723 0.84 HSP90AA1 (0.74) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Pentaquine SCHEMBL29596989 0.84 HSP90AA1 (0.74) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
SCHEMBL8900580 0.83 HSP90AA1 (0.98) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105481766-B A kind of preparation method of quinocide and its hydrochloride 河南省科学院高新技术研究中心 2017-11-17 CN claimed
CN-105481766-A Quinocide and preparation method of hydrochloride thereof HIGH & NEW TECH RES CENTER OF HENAN ACAD OF SCIENCES 2016-04-13 CN claimed
US-8889153-B2 Combination of immunomodulator and anti-pathogenic agent NUNES ISEU DA SILVA (BR) 2014-11-18 US claimed
EP-2259799-B1 COMBINATION OF IMMUNOMODULATOR AND ANTI-PATHOGENIC AGENT NUNES ISEU DA SILVA (BR) 2014-03-12 EP claimed
EP-2560634-A1 NITRIC OXIDE RELEASING PRODRUGS OF THERAPEUTIC AGENTS Piramal Enterprises Limited (IN) 2013-02-27 EP claimed
WO-2013018069-A1 COMBINATION OF ANTIMALARIAL AGENTS ACTELION PHARMACEUTICALS LTD (CH) 2013-02-07 WO claimed
US-20120121724-A1 FILM COMPRISING THERAPEUTIC AGENTS MAIBACH TODD (US) 2012-05-17 US claimed
WO-2011132171-A1 NITRIC OXIDE RELEASING PRODRUGS OF THERAPEUTIC AGENTS PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-10-27 WO claimed
US-20110263526-A1 Nitric Oxide Releasing Prodrugs of Therapeutic Agents PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-10-27 US claimed
US-20110028385-A1 Combination of Immunomodulator and Anti-Pathogenic Agent NUNES ISEU DA SILVA 2011-02-03 US claimed
WO-2005004989-A2 FILM COMPRISING THERAPEUTIC AGENTS MAIBACH TODD (US) 2005-01-20 WO claimed
EP-1135481-A1 NEW OLIGOMERIC CONJUGATES LIABLE TO TRANSFER BIOLOGICAL MOLECULES INTO CELLS I.D.M. IMMUNO-DESIGNED MOLECULES (FR) 2001-09-26 EP claimed
EP-1073470-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING COMPOUNDS WITH ACTIVITY FOR THE ENHANCEMENT OF ABSORPTION OF ACTIVE INGREDIENTS INPHARMA S.A. (CH) 2001-02-07 EP claimed
WO-2000048636-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING COMPOUNDS WITH ACTIVITY FOR THE ENHANCEMENT OF ABSORPTION OF ACTIVE INGREDIENTS INPHARMA S.A. (CH) 2000-08-24 WO claimed
WO-2000032764-A1 NEW OLIGOMERIC CONJUGATES LIABLE TO TRANSFER BIOLOGICAL MOLECULES INTO CELLS I.D.M. IMMUNO-DESIGNED MOLECULES (FR) 2000-06-08 WO claimed
WO-1996009049-A1 INHIBITION OF PLASMODIA PARASITES BY CAMPTOTHECIN COMPOUNDS RESEARCH TRIANGLE INSTITUTE (US) 1996-03-28 WO claimed
EP-0422097-B1 METHOD OF INHIBITING THE ACTIVITY OF HUMAN IMMUNODEFICIENCY VIRUS (HIV) IN VIVO DAVIS MICHAEL H (US) 1994-04-27 EP claimed
EP-0422097-A4 METHOD OF INHIBITING THE ACTIVITY OF HUMAN IMMUNODEFICIENCY VIRUS (HIV) IN VIVO 1992-03-11 EP claimed
EP-0422097-A1 METHOD OF INHIBITING THE ACTIVITY OF HUMAN IMMUNODEFICIENCY VIRUS (HIV) IN VIVO. DAVIS MICHAEL H (US) 1991-04-17 EP claimed
WO-1990000055-A1 METHOD OF INHIBITING THE ACTIVITY OF HUMAN IMMUNODEFICIENCY VIRUS (HIV) IN VIVO DAVIS MICHAEL H (US) 1990-01-11 WO claimed

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-20110263526-A1 Nitric Oxide Releasing Prodrugs of Therapeutic Agents NOS2, NOS1, NOS3 MEN1 2829/4885KMT2A 3867/4885HSP90AA1 2001/4885

“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.