Quinoline

Quinoline

SCHEMBL5874264

O=C(O)C=CC(=O)O.c1ccc2ncccc2c1

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol

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
MEN1 known ✓ O00255 3/20 0.45
KMT2A known ✓ Q03164 3/20 0.45
ALDH1A1 P00352 5/20 0.65
KDM4E B2RXH2 6/20 0.54
LMNA P02545 1/20 0.54
RAB9A P51151 2/20 0.54
CYP3A4 P08684 2/20 0.51
RECQL P46063 1/20 0.50
HSD17B10 Q99714 1/20 0.47
PABPC1 P11940 1/20 0.46
MAPT P10636 2/20 0.45
NPC1 O15118 1/20 0.45
POLB P06746 1/20 0.45
MGAM O43451 2/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
BCAT1 P54687 1/20 0.43
MCL1 Q07820 1/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 1/20 0.42

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 SCHEMBL11274861 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL7884120 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL27293512 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL27800002 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL7886400 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL7886403 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL5874270 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL5874253 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL5874841 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL28116721 0.93 ALDH1A1 (0.57) ALDH1A1KDM4ELMNARAB9ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104903321-B Three ring benzimidazoles are substituted as kinase inhibitor 赛尔维他股份公司 2017-10-24 CN claimed
CN-105377826-A Process for producing heterocyclic compound NISSAN CHEMICAL IND LTD 2016-03-02 CN claimed
CN-104903321-A Substituted tricyclic benzimidazoles as kinase inhibitors SELVITA S A 2015-09-09 CN claimed
CN-121703302-A Method for determining Bedaquinoline fumarate cleaning verification target residues 陕西汉江药业集团股份有限公司 2026-03-20 CN disclosed
CN-120992801-A Method for detecting maleic acid residues in bedaquiline fumarate 陕西汉江药业集团股份有限公司 2025-11-21 CN disclosed
CN-118150734-A Method for detecting optical isomer in bedaquiline fumarate 浙江海正药业股份有限公司 2024-06-07 CN disclosed
CN-118150734-A Method for detecting optical isomer in bedaquiline fumarate 浙江海正药业股份有限公司 2024-06-07 CN disclosed
CN-117603137-A Method for chiral synthesis of (1R, 2S) -bedaquiline 沈阳红旗制药有限公司 2024-02-27 CN disclosed
CN-117269345-A Liquid phase detection method for small molecular organic amine substances 陕西汉江药业集团股份有限公司 2023-12-22 CN disclosed
CN-113527305-A Pharmaceutically acceptable salts of quinoline TGF-beta 1 inhibitor and preparation method thereof 南京圣和药物研发有限公司 2021-10-22 CN disclosed
CN-109422679-A A kind of shellfish is up to the purifying of quinoline and the preparation method of stable crystal form 武汉武药科技有限公司 2019-03-05 CN disclosed
CN-1143675-C Heteroarylpiperidines, pyrrolidines and piprazines and their use as antipsychotics and analgetics ���µ�˹ҩ�﹫˾ 2004-03-31 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
US-RE37478-E1 COMPOUNDS WITH HETEROCYCLIC AMINO COMPOUNDS AVENTIS PHARMACEUTICALS, INC. 2001-12-18 US disclosed
CN-1037266-C Quinoline derivative fumarates MITSUI TOATSU CHEMICALS (JP) 1998-02-04 CN disclosed
CN-1083476-A The fumarate of quinoline MITSUI TOATSU CHEMICALS (JP) 1994-03-09 CN disclosed
US-5104885-A 5-(phenylalkoxy)primaquine and 5[(heterocycle)alkoxy] primaquine compounds and their use for treatment of malaria CALSPAN CORPORATION (US) 1992-04-14 US disclosed
CN-85105798-A Octahydro- azoles is the preparation method of [4,5-g] quinoline also 1987-01-28 CN disclosed
CN-85101547-A The preparation method and its usage of novel octahydro thiazole [4,5-g] and quinoline compound 1987-01-24 CN disclosed
US-4311844-A Octahydro-2H-pyrrolo[3,4,-g]quinolines ELI LILLY AND COMPANY (US) 1982-01-19 US disclosed