SCHEMBL450833

SCHEMBL450833

N#Cc1ccc([C]=O)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
EGLN2 Q96KS0 2/20 0.38
CHEK1 O14757 1/20 0.37
AR P10275 1/20 0.36
KCNQ3 O43525 1/20 0.36
KCNQ2 O43526 1/20 0.36
SLC40A1 Q9NP59 1/20 0.33
CYP19A1 P11511 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33

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
SCHEMBL1026572 0.84 ALDH1A1 (0.48) KDM4EALDH1A1L3MBTL1LMNAGAA
SCHEMBL11776219 0.84 GRM5 (0.33)
SCHEMBL454402 0.83 ALDH1A1 (0.43) KDM4EALDH1A1L3MBTL1LMNAGAA
SCHEMBL169677 0.78 GRM5 (0.40) KDM4EALDH1A1L3MBTL1LMNAGAA
SCHEMBL16116339 0.75 KDM4E (0.36) KDM4EALDH1A1L3MBTL1LMNAGAA
SCHEMBL16379694 0.74 CHEK1 (0.37) KDM4EALDH1A1L3MBTL1LMNAGAA
SCHEMBL455706 0.73
SCHEMBL9024185 0.72 CYP11B2 (0.53) EGLN2CHEK1GABRA1GABRG2GABRB3
SCHEMBL14061390 0.72 GRM5 (0.43) CHEK1
SCHEMBL15903117 0.72 GRM5 (0.36) KDM4EALDH1A1L3MBTL1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100234390-A1 NOVEL COMPOUND AND THEIR USE ORCHID RESEARCH LABORATORIES LIMITED (IN) 2010-09-16 US claimed
EP-2170874-A2 NOVEL COMPOUNDS AND THEIR USE Orchid Research Laboratories Limited (IN) 2010-04-07 EP claimed
WO-2009001192-A2 NOVEL COMPOUNDS AND THEIR USE ORCHID RESEARCH LABORATORIES LIMITED (IN) 2008-12-31 WO claimed
WO-2023212510-A1 METHODS FOR TREATING NEURODEGENERATIVE DISORDERS PRAETEGO INC (US) 2023-11-02 WO disclosed
US-20230338344-A1 AMPK Activators and Methods of Use Thereof BIOVERATIV THERAPEUTICS INC. (US) 2023-10-26 US disclosed
EP-4221700-A1 AMPK ACTIVATORS AND METHODS OF USE THEREOF Bioverativ Therapeutics Inc. (US) 2023-08-09 EP disclosed
EP-4007632-A1 INHIBITORS OF ADVANCED GLYCATION END PRODUCTS Praetego, Inc. (US) 2022-06-08 EP disclosed
CN-114502546-A Inhibitors of advanced glycation endproducts 普拉特戈公司 2022-05-13 CN disclosed
US-20210163450-A1 Inhibitors of Advanced Glycation End Products PRAETEGO INC 2021-06-03 US disclosed
WO-2021022215-A1 INHIBITORS OF ADVANCED GLYCATION END PRODUCTS KHALIFAH RAJA G (US) 2021-02-04 WO disclosed
US-9783527-B2 Indazole ureas and method of use ABBVIE INC. (US) 2017-10-10 US disclosed
EP-1740579-A1 TRICYCLIC PYRAZOLE KINASE INHIBITORS Abbott Laboratories (US) 2007-01-10 EP disclosed
WO-2006083673-A2 PYRIDINE DERIVATIVES USEFUL AS INHIBITORS OF C-JUN N-TERMINAL KINASES ABBOTT LABORATORIES (US) 2006-08-10 WO disclosed
US-20060173050-A1 Inhibitors of c-Jun N-terminal kinases ABBVIE INC. 2006-08-03 US disclosed
US-20060014816-A1 Tricyclic pyrazole kinase inhibitors ABBVIE INC. 2006-01-19 US disclosed
WO-2005095387-A1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2005-10-13 WO disclosed
US-20050171132-A1 Diaminopyrimidine derivatives as selective growth hormone secrectgogue receptor (GHS-R) antagonists XIN ZHILI (US) 2005-08-04 US disclosed
US-20050171131-A1 Diaminopyrimidine derivatives as growth hormone secrectgogue receptor (GHS-R) antagonists KOSOGOF CHRISTI (US) 2005-08-04 US disclosed
WO-2005030734-A1 DIAMINOPYRIMIDINE DERIVATIVES AS SELECTIVE GROWTH HORMONE SECRECTGOGUE RECEPTOR (GHS-R) ANTAGONISTS ABBOTT LABORATORIES (US) 2005-04-07 WO disclosed
US-20050070712-A1 Pyrimidine derivatives as ghrelin receptor modulators ABBOTT LABORATORIES 2005-03-31 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 (8 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-20060173050-A1 Inhibitors of c-Jun N-terminal kinases MAPKAPK3, MAP3K3, MAPK3 KDM4E 2987/4885ALDH1A1 4339/4885L3MBTL1 1511/4885
US-20230338344-A1 AMPK Activators and Methods of Use Thereof PRKAG2, PRKAG3, PRKAG1 KDM4E 2836/4885ALDH1A1 952/4885L3MBTL1 2204/4885
US-20050171131-A1 Diaminopyrimidine derivatives as growth hormone secrectgogue receptor (GHS-R) antagonists GHSR, GIPR, GPR119 KDM4E 1308/4885ALDH1A1 2435/4885L3MBTL1 4050/4885
US-20050171132-A1 Diaminopyrimidine derivatives as selective growth hormone secrectgogue receptor (GHS-R) antagonists GHSR, GIPR, GPR119 KDM4E 1366/4885ALDH1A1 3084/4885L3MBTL1 4194/4885
US-20060014816-A1 Tricyclic pyrazole kinase inhibitors PRKDC, PRKACA, PIK3C3 KDM4E 1449/4885ALDH1A1 3901/4885L3MBTL1 3013/4885
US-20050070712-A1 Pyrimidine derivatives as ghrelin receptor modulators GPR119, GIPR, GCGR KDM4E 1540/4885ALDH1A1 2333/4885L3MBTL1 4387/4885
US-20210163450-A1 Inhibitors of Advanced Glycation End Products AGER, GLA, GPR119 KDM4E 1590/4885ALDH1A1 470/4885L3MBTL1 2463/4885
US-20100234390-A1 NOVEL COMPOUND AND THEIR USE HTRA1, PRSS1, PRNP KDM4E 4135/4885ALDH1A1 3866/4885L3MBTL1 3793/4885

“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.