SCHEMBL1479815

SCHEMBL1479815

Clc1cccc(-c2ccco2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.53
PRMT6 Q96LA8 1/20 0.50
PIK3R1 P27986 1/20 0.47
PIK3CA P42336 1/20 0.47
ALDH1A1 P00352 4/20 0.46
RAB9A P51151 3/20 0.46
NOTUM Q6P988 1/20 0.46
TAAR1 Q96RJ0 2/20 0.46
SOS1 Q07889 1/20 0.45
GABRP O00591 2/20 0.44
GABRD O14764 2/20 0.44
GABRA1 P14867 2/20 0.44
GABRB1 P18505 2/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44
GABRA3 P34903 2/20 0.44
GABRA2 P47869 2/20 0.44
GABRB2 P47870 2/20 0.44
GABRA4 P48169 2/20 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
SCHEMBL29498760 1.00 KEAP1 (0.53) KEAP1PRMT6PIK3R1PIK3CAALDH1A1
SCHEMBL244155 0.79
SCHEMBL28323221 0.77 TAAR1 (0.62) KEAP1PRMT6ALDH1A1RAB9ATAAR1
SCHEMBL27761661 0.77 KEAP1 (0.59) KEAP1PRMT6PIK3R1PIK3CAALDH1A1
SCHEMBL1478175 0.76 TAAR1 (0.61) PIK3R1PIK3CAALDH1A1RAB9ANOTUM
SCHEMBL23567449 0.75 PIK3R1 (0.54) KEAP1PRMT6PIK3R1PIK3CAALDH1A1
SCHEMBL6765578 0.75 KEAP1 (0.58) KEAP1PRMT6ALDH1A1RAB9ATAAR1
SCHEMBL2462178 0.75 TAAR1 (0.61) KEAP1PRMT6ALDH1A1TAAR1KDM4E
SCHEMBL22423671 0.75 KEAP1 (0.53) KEAP1PRMT6PIK3R1PIK3CAALDH1A1
SCHEMBL11064449 0.75 PRMT6 (0.54) KEAP1PRMT6ALDH1A1RAB9ATAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105209449-B Inhibitors of the kynurenine pathway 库拉德夫制药私人有限公司 2019-02-01 CN claimed
CN-106052158-A Special tank type heat exchange device for manganese slag light ceramic tile additive, control method and key component manufacturing process of special tank type heat exchange device 徐州工程学院 2016-10-26 CN claimed
CN-114425390-B Preparation method and application of 3D printing catalyst loaded with carbon quantum dots 南京师范大学 2024-07-09 CN disclosed
CN-114516880-B Method for synthesizing furo [2,3-b ] quinoxaline derivative 桂林理工大学 2023-11-17 CN disclosed
CN-114616280-B Heterophasic propylene ethylene copolymer compositions with desirable balance of mechanical properties 北欧化工公司 2023-10-13 CN disclosed
CN-114516880-A Novel method for synthesizing furo [2,3-b ] quinoxaline derivative 桂林理工大学 2022-05-20 CN disclosed
CN-114425390-A Preparation method and application of carbon quantum dot-loaded 3D printing catalyst 南京师范大学 2022-05-03 CN disclosed
CN-106052158-A Special tank type heat exchange device for manganese slag light ceramic tile additive, control method and key component manufacturing process of special tank type heat exchange device 徐州工程学院 2016-10-26 CN disclosed
US-7915280-B2 Compounds and their uses EISAI INC. (US) 2011-03-29 US disclosed
US-RE41150-E1 Poly(adenosine 5'-diphospho-ribose) polymerase (PARP) inhibitors; compounds based on thieno(4,3,2-ef)(2)benzazepin-6-one EISAI CORPORATION OF NORTH AMERICA (US) 2010-02-23 US disclosed
US-7662839-B2 EP2 receptor agonists ASTERAND UK LIMITED (GB) 2010-02-16 US disclosed
US-7235557-B2 Compounds and their uses MGI GP, INC. (US) 2007-06-26 US disclosed
US-20060142266-A1 Compounds and their uses MGI GP, INC. (US) 2006-06-29 US disclosed
US-20060003987-A1 Compounds and their uses GUILFORD PHARMACEUTICALS, INC. (US) 2006-01-05 US disclosed
US-20050148575-A1 (Di)Azepino[5,4,3-cd]benzothiophenes; poly(ADP-ribose) polymerase (PARP) and glycohydrolase (PARG) inhibitor; antiinflammatory; protects cells, tissue and organs against the ill-effects of reactive free radicals and nitric oxide, and damage following focal ischemia and reperfusion injury GUILFORD PHARMACEUTICALS INC. (US) 2005-07-07 US disclosed
US-6887996-B2 Poly(adenosine 5'-diphospho-ribose) polymerase (PARP) inhibitors; compounds based on thieno(4,3,2-ef)(2)benzazepin-6-one GUILFORD PHARMACEUTICALS INC. (US) 2005-05-03 US disclosed
CN-1474816-A 4-amino-quinazolines Ĭ��ר���ɷ����޹�˾ 2004-02-11 CN disclosed
EP-1339402-A2 BENZOAZEPINE AND BENZODIAZEPINE DERIVATIVES AND THEIR USE AS PARP INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 2003-09-03 EP disclosed
US-20030022883-A1 Compounds and their use EISAI INC. 2003-01-30 US disclosed
WO-2002044183-A2 BENZOAZEPINE AND BENZODIAZEPINE DERIVATIVES AND THEIR USE AS PARP INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 2002-06-06 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 (4 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-20030022883-A1 Compounds and their use PARP1, PARP2, PARP3 KEAP1 324/4885PRMT6 959/4885PIK3R1 343/4885
US-20060003987-A1 Compounds and their uses PARP1, PARP2, PARP3 KEAP1 563/4885PRMT6 941/4885PIK3R1 575/4885
US-20050148575-A1 (Di)Azepino[5,4,3-cd]benzothiophenes; poly(ADP-ribose) polymerase (PARP) and glycohydrolase (PARG) inhibitor; antiinflammatory; protects cells, tissue and organs against the ill-effects of reactive free radicals and nitric oxide, and damage following focal ischemia and reperfusion injury PARP1, PARP11, PARP15 KEAP1 558/4885PRMT6 1879/4885PIK3R1 1076/4885
US-20060142266-A1 Compounds and their uses PARP1, PARP2, PARP3 KEAP1 563/4885PRMT6 941/4885PIK3R1 575/4885

“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.