SCHEMBL1242568

SCHEMBL1242568

CCOC(=O)c1c[nH]c2cc(F)c(F)cc2c1=O

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.70
GABRB2 P47870 4/20 0.70
GABRB1 P18505 3/20 0.64
GABRA3 P34903 3/20 0.64
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C19 P33261 1/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
ALDH1A1 P00352 1/20 0.56
TP53 P04637 1/20 0.56
HPGD P15428 1/20 0.56
HSD17B10 Q99714 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
CLEC4M Q9H2X3 1/20 0.54
KDM4E B2RXH2 1/20 0.51

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
SCHEMBL7164261 0.92 GABRA1 (0.63) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL17242463 0.90 GABRA1 (0.66) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL29576698 0.90 GABRA1 (0.60) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL5681642 0.90 GABRA1 (0.60) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL18987742 0.90 GABRA1 (0.60) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL10519075 0.90 GABRA1 (0.66) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL2031515 0.89 GABRA1 (0.59) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL28289153 0.86 GABRA1 (0.69) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL10867175 0.85 GABRA1 (0.58) GABRA1GABRB2GABRB1GABRA3CYP1A2
SCHEMBL4840379 0.85 GABRA1 (0.56) GABRA1GABRB2GABRB1GABRA3CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3694851-B1 ENVIRONMENTALLY DEGRADABLE QUINOLONE ANTIBIOTICS HAVING A HEMIAMINAL STRUCTURAL UNIT LEUPHANA UNIV LUENEBURG STIFTUNG OEFFENTLICHEN RECHTS (DE) 2023-12-27 EP disclosed
EP-3390384-B1 QUINOLINE-3-CARBOXAMIDES AS H-PGDS INHIBITORS ASTEX THERAPEUTICS LTD (GB) 2021-09-15 EP disclosed
US-20210238162-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-08-05 US disclosed
EP-3694851-A1 ENVIRONMENTALLY DEGRADABLE QUINOLONE ANTIBIOTICS HAVING A HEMIAMINAL STRUCTURAL UNIT Leuphana Universität Lüneburg Stiftung Öffentlichen Rechts (DE) 2020-08-19 EP disclosed
WO-2019072905-A1 ENVIRONMENTALLY DEGRADABLE QUINOLONE ANTIBIOTICS HAVING A HEMIAMINAL STRUCTURAL UNIT LEUPHANA UNIVERSITAET LUENEBURG STIFTUNG OEFFENTLICHEN RECHTS (DE) 2019-04-18 WO disclosed
US-10150736-B2 Haptens and immunoreactive agents and use thereof for producing family antibodies and immunoassays for quinolones CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (CSIC) (ES) 2018-12-11 US disclosed
EP-3390384-A1 QUINOLINE-3-CARBOXAMIDES AS H-PGDS INHIBITORS Astex Therapeutics Limited (GB) 2018-10-24 EP disclosed
WO-2017103851-A1 QUINOLINE-3-CARBOXAMIDES AS H-PGDS INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2017-06-22 WO disclosed
US-20130273581-A1 HAPTENS AND IMMUNOREACTIVE AGENTS AND USE THEREOF FOR PRODUCING FAMILY ANTIBODIES AND IMMUNOASSAYS FOR QUINOLONES CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (CSIC) (ES) 2013-10-17 US disclosed
US-7879878-B2 such as {2-[({[7-(cyclohexylamino)-6-fluoro-4-oxo-1-[(3S)-tetrahydrofuran-3-yl]-1,4-dihydroquinolin-3-yl}carbonyl)amino]ethyl}phosphonic acid, used as platelet aggregation inhibitor and purinergic receptor (P2Y12) inhibitors; therapy for circulatory diseases involving thrombosis via platelet aggregation ASTELLAS PHARMA INC. (JP) 2011-02-01 US disclosed
EP-1083920-A1 NOVEL ANTIBACTERIAL COMPOUNDS Advanced Medicine, Inc. (US) 2001-03-21 EP disclosed
EP-0989857-A4 NOVEL THERAPEUTIC AGENTS THAT MODULATE ENZYMATIC PROCESSES ADVANCED MEDICINE INC (US) 2001-01-17 EP disclosed
EP-0989857-A1 NOVEL THERAPEUTIC AGENTS THAT MODULATE ENZYMATIC PROCESSES Advanced Medicine, Inc. (US) 2000-04-05 EP disclosed
WO-1999064037-A1 NOVEL THERAPEUTIC AGENTS THAT MODULATE ENZYMATIC PROCESSES ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed
WO-1999064051-A1 NOVEL ANTIBACTERIAL COMPOUNDS ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed
EP-0321191-B1 Heterocyclic-substituted quinoline-carboxylic acids PFIZER (US) 1994-11-02 EP disclosed
US-5214051-A Thiazolyl and oxazolyl[5,4-c]piperidyl-substituted quinolone-carboxylic acid and related analogs thereof having antibacterial properties are disclosed PFIZER INC. (US) 1993-05-25 US disclosed
US-5037834-A Heterocycylic-substituted quinoline-carboxylic acids PFIZER INC. (US) 1991-08-06 US disclosed
EP-0200307-B1 IMPROVED PROCESS FOR PRODUCTION OF QUINOLINE-3-CARBOXYLIC ACID ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1989-12-20 EP disclosed
WO-1989005643-A1 HETEROCYCLIC-SUBSTITUTED QUINOLINE-CARBOXYLIC ACIDS PFIZER INC. (US) 1989-06-29 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 (3 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-20130273581-A1 HAPTENS AND IMMUNOREACTIVE AGENTS AND USE THEREOF FOR PRODUCING FAMILY ANTIBODIES AND IMMUNOASSAYS FOR QUINOLONES NQO2, NISCH, VIP GABRA1 2098/4885GABRB2 2831/4885GABRB1 2980/4885
US-10150736-B2 Haptens and immunoreactive agents and use thereof for producing family antibodies and immunoassays for quinolones NQO2, NISCH, VIP GABRA1 2098/4885GABRB2 2831/4885GABRB1 2980/4885
US-20210238162-A1 CHEMICAL COMPOUNDS HPGDS, PTGS1, PTGIS GABRA1 3120/4885GABRB2 3784/4885GABRB1 3386/4885

“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.