Quinoline

Quinoline

SCHEMBL5874220

O=[N+]([O-])O.c1ccc2ncccc2c1

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ERG11

The experimentally established mechanism targets of Quinoline. 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
ALDH1A1 P00352 7/20 0.68
POLB P06746 3/20 0.49
PDE10A Q9Y233 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CASP1 P29466 2/20 0.46
CASP7 P55210 1/20 0.46
NPC1 O15118 3/20 0.44
RAB9A P51151 2/20 0.44
MAPT P10636 4/20 0.44
KDM4E B2RXH2 3/20 0.44
HTT P42858 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HSP90AA1 P07900 2/20 0.44
HSP90AB1 P08238 2/20 0.44
PKM P14618 1/20 0.44
NFKB1 P19838 1/20 0.44
CASP6 P55212 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44

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
Quinoline SCHEMBL28090169 0.98 ALDH1A1 (0.65) ALDH1A1POLBPDE10AMEN1KMT2A
Quinoline SCHEMBL11837716 0.88 ALDH1A1 (0.53) ALDH1A1POLBPDE10AMEN1KMT2A
Quinoline SCHEMBL11837706 0.88 ALDH1A1 (0.53) ALDH1A1POLBPDE10AMEN1KMT2A
Quinoline SCHEMBL27700047 0.85 ALDH1A1 (0.85) ALDH1A1POLBMEN1KMT2ACASP1
Quinoline SCHEMBL27814435 0.85 POLB (0.64) ALDH1A1POLBPDE10AMEN1KMT2A
Quinoline SCHEMBL7208557 0.83 ALDH1A1 (0.90) ALDH1A1POLBMEN1KMT2ACASP1
Quinoline SCHEMBL32661377 0.82 ALDH1A1 (1.00) ALDH1A1POLBPDE10AMEN1KMT2A
Quinoline SCHEMBL29349552 0.82 ALDH1A1 (1.00) ALDH1A1POLBPDE10AMEN1KMT2A
Quinoline SCHEMBL29822171 0.82 ALDH1A1 (1.00) ALDH1A1POLBPDE10AMEN1KMT2A
Quinoline SCHEMBL2774 0.82 ALDH1A1 (1.00) ALDH1A1POLBPDE10AMEN1KMT2A

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-53044576-A None JP disclosed
CN-113046737-A Method for treating metal surface by using hydroxylamine zinc phosphating solution 廊坊师范学院 2021-06-29 CN disclosed
CN-106399146-B Bacillus subtilis ZKGS01 and its application in prevention and treatment fungal diseases of plants 北京中科金株生物科技有限公司 2019-07-16 CN disclosed
CN-105572127-A Preparation method of quimociac reagent TIANJIN GUANGFU TECH DEV CO LTD 2016-05-11 CN disclosed
US-7128976-B2 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2006-10-31 US disclosed
CN-1193792-C Stable medicinal composition for oral use YAMANOUCHI PHARMA CO LTD (JP) 2005-03-23 CN disclosed
CN-1142145-C Process for preparation of 2,3-pyridine dicarboxylic acid DSM��ϸ��ѧ�µ������޹�˾ 2004-03-17 CN disclosed
US-20030091838-A1 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2003-05-15 US disclosed
CN-1373673-A Stable medicinal composition for oral use YAMANOUCHI PHARMA CO LTD (JP) 2002-10-09 CN disclosed
US-6395903-B1 REACTING A QUINOLINE IN AQUEOUS SULFURIC ACID OR NITRIC ACID SOLUTION WITH OZONE, AND THEN REACTING THE RESULTING PEROXIDE SOLUTION WITH AN OXIDIZING AGENT; ADJUSTING THE PH TO 0.2 TO 3; COOLING TO 0-30 DEGREES C.; ISOLATION DSM FINE CHEMICALS AUSTRIA NFG GMBH & COKG (AT) 2002-05-28 US disclosed
US-20020062025-A1 PROCESS FOR THE PREPARATION OF 2,3-PYRIDINEICARBOXYLIC ACIDS DSM FINE CHEMICALS AUSTRIA NFG GMBH & COKG (AT) 2002-05-23 US disclosed
CN-1274720-A Process for preparation of 2,3-pyridine dicarboxylic acid DSM FINE CHEMICAL AUSTRIA GMBH (AT) 2000-11-29 CN disclosed
JP-S5344576-A NITRATION OF QUINOLEINES TEIJIN LTD 1978-04-21 JP 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-20020062025-A1 PROCESS FOR THE PREPARATION OF 2,3-PYRIDINEICARBOXYLIC ACIDS CBR1, HAO2, SCO2 ALDH1A1 482/4885POLB 826/4885PDE10A 1754/4885

“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.