SCHEMBL19429565

SCHEMBL19429565

CCS(=O)(=O)CC(=O)c1cnc(OC)cn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.54
APLNR P35414 4/20 0.38
NNMT P40261 2/20 0.36
OXTR P30559 4/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
MAPT P10636 3/20 0.33
AVPR1A P37288 2/20 0.33
KDM4E B2RXH2 1/20 0.33
USP2 O75604 1/20 0.33
BACE1 P56817 1/20 0.33
AVPR2 P30518 1/20 0.33
PABPC1 P11940 1/20 0.32
MKNK1 Q9BUB5 1/20 0.32
MKNK2 Q9HBH9 1/20 0.32
NPC1 O15118 1/20 0.32
S1PR2 O95136 1/20 0.32
S1PR4 O95977 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL27964383 0.82 SIRT6 (0.62) SIRT6APLNRNNMTOXTRMEN1
SCHEMBL21778758 0.79 CNR2 (0.37) SIRT6BACE1
SCHEMBL21778743 0.78 SIRT6 (0.49) SIRT6KMT2AMAPTKDM4ENPC1
SCHEMBL15751614 0.77 SIRT6 (0.61) SIRT6APLNRNNMTMEN1KMT2A
SCHEMBL14684026 0.77 SIRT6 (0.61) SIRT6APLNRNNMTOXTRMEN1
SCHEMBL27635499 0.72 SIRT6 (0.59) SIRT6MEN1KMT2AMAPTKDM4E
SCHEMBL347508 0.72 SIRT6 (0.75) SIRT6APLNRNNMTMAPTKDM4E
SCHEMBL14113834 0.72 SIRT6 (0.69) SIRT6APLNRNNMTOXTRMEN1
SCHEMBL31132573 0.72 SIRT6 (0.75) SIRT6APLNRNNMTMAPTKDM4E
SCHEMBL23369518 0.71 LMNA (0.37) MEN1KMT2AMAPTNPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3444245-B1 HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL CO (JP) 2022-02-23 EP disclosed
US-20210347757-A1 HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-11-11 US disclosed
US-11149027-B2 Heterocyclic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-10-19 US disclosed
US-11124480-B2 Heterocyclic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-09-21 US disclosed
US-11124492-B2 Heterocyclic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-09-21 US disclosed
US-20210230137-A1 PYRAZINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-07-29 US disclosed
US-11001567-B2 Pyrazine compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-05-11 US disclosed
US-20200239418-A1 HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-07-30 US disclosed
US-10662157-B2 Heterocyclic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-05-26 US disclosed
US-20200109128-A1 PYRAZINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-04-09 US disclosed
US-10577343-B2 Pyrazine compound and arthropod pest control agent containing same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-03-03 US disclosed
US-20190127328-A1 HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-05-02 US disclosed
US-20190106411-A1 HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-04-11 US disclosed
EP-3444245-A1 HETEROCYCLIC COMPOUND Sumitomo Chemical Company, Limited (JP) 2019-02-20 EP disclosed
US-20190040038-A1 HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-02-07 US disclosed
EP-3424905-A1 HETEROCYCLIC COMPOUND Sumitomo Chemical Company, Limited (JP) 2019-01-09 EP disclosed
WO-2017175613-A1 HETEROCYCLIC COMPOUND 住友化学株式会社 2017-10-12 WO disclosed
WO-2017169894-A1 HETEROCYCLIC COMPOUND 住友化学株式会社 2017-10-05 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 (13 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-20200239418-A1 HETEROCYCLIC COMPOUND ALOX15B, ALOX12, PTGER1 SIRT6 2913/4885APLNR 4342/4885NNMT 2057/4885
US-20210230137-A1 PYRAZINE COMPOUND PPOX, NOX5, NISCH SIRT6 1562/4885APLNR 2543/4885NNMT 427/4885
US-10577343-B2 Pyrazine compound and arthropod pest control agent containing same PPOX, NOX5, NISCH SIRT6 1534/4885APLNR 2258/4885NNMT 439/4885
US-20190040038-A1 HETEROCYCLIC COMPOUND NR4A2, NR4A1, NR2C2 SIRT6 3572/4885APLNR 2292/4885NNMT 1301/4885
US-20210347757-A1 HETEROCYCLIC COMPOUND NR4A2, NR4A1, NR2C2 SIRT6 3572/4885APLNR 2292/4885NNMT 1301/4885
US-11124480-B2 Heterocyclic compound ALOX15B, ALOX12, PTGER1 SIRT6 2913/4885APLNR 4342/4885NNMT 2057/4885
US-20190106411-A1 HETEROCYCLIC COMPOUND ALOX15B, ALOX12, ALOX5 SIRT6 3292/4885APLNR 4407/4885NNMT 1905/4885
US-10662157-B2 Heterocyclic compound ALOX15B, ALOX12, PTGER1 SIRT6 2913/4885APLNR 4342/4885NNMT 2057/4885
US-11149027-B2 Heterocyclic compound ALOX15B, ALOX12, ALOX5 SIRT6 3292/4885APLNR 4407/4885NNMT 1905/4885
US-11001567-B2 Pyrazine compound PPOX, NOX5, NISCH SIRT6 1562/4885APLNR 2543/4885NNMT 427/4885
US-11124492-B2 Heterocyclic compound NR4A2, NR4A1, NR2C2 SIRT6 3572/4885APLNR 2292/4885NNMT 1301/4885
US-20200109128-A1 PYRAZINE COMPOUND PPOX, NOX5, NISCH SIRT6 1562/4885APLNR 2543/4885NNMT 427/4885
US-20190127328-A1 HETEROCYCLIC COMPOUND ALOX15B, ALOX12, PTGER1 SIRT6 2913/4885APLNR 4342/4885NNMT 2057/4885

“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.