Quinocide

Quinocide

SCHEMBL2286358

COc1cc(NCCCC(C)N)c2ncccc2c1.O=P(O)(O)O

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Quinocide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 known ✓ P07550 1/20 0.56
ADRB1 known ✓ P08588 1/20 0.56
OPRM1 known ✓ P35372 1/20 0.56
KCNH2 known ✓ Q12809 1/20 0.56
MEN1 O00255 3/20 0.88
KMT2A Q03164 3/20 0.88
HSP90AA1 P07900 11/20 0.86
HSP90AB1 P08238 11/20 0.86
ALDH1A1 P00352 4/20 0.86
KDM4E B2RXH2 3/20 0.86
THRB P10828 2/20 0.86
HTT P42858 2/20 0.86
TDP2 O95551 1/20 0.86
FGB P02675 1/20 0.86
POLB P06746 1/20 0.86
GAA P10253 1/20 0.86
MAPT P10636 1/20 0.86
TSHR P16473 1/20 0.86
NR4A1 P22736 1/20 0.86
RECQL P46063 1/20 0.86

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 SCHEMBL157174 0.94 MEN1 (1.00) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Quinocide SCHEMBL29720457 0.94 MEN1 (1.00) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Quinocide SCHEMBL30823571 0.93 HSP90AA1 (1.00) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Quinocide SCHEMBL707955 0.93 HSP90AA1 (1.00) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Quinocide SCHEMBL28060369 0.93 HSP90AA1 (1.00) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Pentaquine SCHEMBL6081373 0.86 HSP90AA1 (0.67) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Phosphoric Acid SCHEMBL11544230 0.84 MEN1 (0.62) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Phosphoric Acid SCHEMBL11546533 0.83 CASP6 (0.94) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
Phosphoric Acid SCHEMBL9719166 0.82 HSP90AA1 (0.65) MEN1KMT2AHSP90AA1HSP90AB1ALDH1A1
SCHEMBL17792862 0.80 HSP90AA1 (0.93) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025064210-A1 INHIBITORS OF BILIVERDIN REDUCTASE B (BLVRB) BLOOD CELL TECHNOLOGIES, LLC (US) 2025-03-27 WO disclosed
WO-2022173818-A1 USE OF BILIVERDIN REDUCTASE B INHIBITORS TO ALLOW MALARIA ERADICATION IN PATIENTS WITH G6PD DEFICIENCY UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2022-08-18 WO disclosed
US-20130053333-A1 Aminoquinoline Derivatives CONCERT PHARMACEUTICALS, INC. 2013-02-28 US disclosed
WO-2011091035-A1 AMINOQUINOLINE DERIVATIVES CONCERT PHARMACEUTICALS, INC. (US) 2011-07-28 WO disclosed
US-4167638-A Process for production of 8-NHR quinolines THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1979-09-11 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 (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-20130053333-A1 Aminoquinoline Derivatives NQO2, QTRT2, RECQL ADRB2 2919/4885ADRB1 2608/4885OPRM1 3725/4885

“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.