SCHEMBL6042880

SCHEMBL6042880

COc1cnc(S(C)(=O)=O)nc1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
PDE4B Q07343 2/20 0.38
HTT P42858 3/20 0.38
NPSR1 Q6W5P4 3/20 0.38
ALDH1A1 P00352 3/20 0.38
NPC1 O15118 2/20 0.38
TLR9 Q9NR96 2/20 0.38
TP53 P04637 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPT P10636 1/20 0.38
XBP1 P17861 1/20 0.38
MAPK1 P28482 1/20 0.38
MEN1 O00255 1/20 0.35
RAB9A P51151 1/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MITF O75030 1/20 0.35
STAT3 P40763 1/20 0.35

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
SCHEMBL7377255 0.81 LMNA (0.44) KMT2ALMNASMN1; SMN2PDE4BHTT
SCHEMBL1442168 0.80 MAPT (0.43) KMT2ALMNASMN1; SMN2PDE4BHTT
SCHEMBL9360855 0.80 SMN1; SMN2 (0.43) KMT2ALMNASMN1; SMN2PDE4BHTT
SCHEMBL22400987 0.80 LMNA (0.43) KMT2ALMNASMN1; SMN2PDE4BHTT
SCHEMBL5410660 0.77 LRRK2 (0.41) KMT2ALMNASMN1; SMN2PDE4BHTT
SCHEMBL25234983 0.76 KDM4E (0.40) KMT2ALMNASMN1; SMN2PDE4BHTT
SCHEMBL15633418 0.76 PTGS2 (0.43) KMT2ALMNASMN1; SMN2PDE4BHTT
SCHEMBL25243394 0.76 KDR (0.44) KMT2ALMNASMN1; SMN2HTTNPSR1
SCHEMBL31726565 0.76 KDR (0.44) KMT2ALMNASMN1; SMN2HTTNPSR1
SCHEMBL6880043 0.71 HTT (0.51) KMT2ALMNASMN1; SMN2PDE4BHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105130908-B The preparation method and its synthetic intermediate of the cyano methyl pyrimidine of 4,6 dialkoxy 2 组合化学工业株式会社 2018-03-27 CN disclosed
CN-106959345-A A kind of full Isotopic Internal Standard mass spectrum quantitative approach of neurotransmitter metabolite 上海谱领生物科技有限公司 2017-07-18 CN disclosed
CN-105026376-A Process for the preparation of bispyribac-sodium and intermediates thereof GHARDA CHEMICALS LTD 2015-11-04 CN disclosed
CN-102093298-A Pyrimidine ring-containing benzoyl(thio)carbamide compounds with insecticidal activity UNIV HUAZHONG NORMAL 2011-06-15 CN disclosed
CN-101489544-A Method for treating hematological disorders HEMAQUEST PHARMACEUTICALS INC (US) 2009-07-22 CN disclosed
CN-101339187-A Methylsulfonyl miazines isotope labelling reagent, synthesis method and uses thereof SHANGHAI INST ORGANIC CHEM (CN) 2009-01-07 CN disclosed
CN-100418955-C Novel Benzo-fused heterocycles ACTELION PHARMOUEUTICALS LTD (CH) 2008-09-17 CN disclosed
CN-1285581-C Process for the preparation of 4, 6-dimethoxy-2- (methylsulfonyl) -1, 3-pyrimidine SYNGENTA PARITCIPATIONS AG (CH) 2006-11-22 CN disclosed
US-20060079533-A1 Methods of treating alzheimer's disease NIEMAN JAMES A 2006-04-13 US disclosed
CN-1151137-C Preparation method of thiobarbituric acid derivative �����ɷ� 2004-05-26 CN disclosed
WO-2002076440-A2 METHODS OF TREATING ALZHEIMER'S DISEASE WITH PIPERIDIN DERIVATES ELAN PHARMACEUTICALS, INC. (US) 2002-10-03 WO disclosed
CN-1339029-A Method of producing thiobarbituric acid derivatives SINGENTA PARTICIPATION AG (CH) 2002-03-06 CN disclosed
WO-2002008207-A1 PROCESS FOR THE PREPARATION OF 4,6-DIMETHOXY-2-(METHYLSULFONYL)-1,3-PYRIMIDINE SYNGENTA PARTICIPATIONS AG (CH) 2002-01-31 WO disclosed
US-6150526-A Piperidine derivative having renin inhibiting activity HOFFMANN-LA ROCHE INC. (US) 2000-11-21 US disclosed
US-6051712-A PREVENTION OF HIGH BLOOD PRESSURE AND CARDIAC INSUFFICIENCY, AS WELL AS GLAUCOMA, CARDIAC INFARCT, KIDNEY INSUFFICIENCY AND RESTENOSIS HOFFMANN-LA ROCHE INC. (US) 2000-04-18 US disclosed
EP-0863875-A1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY F. HOFFMANN-LA ROCHE AG (CH) 1998-09-16 EP disclosed
US-5627138-A HERBICIDES SANDOZ LTD. (CH) 1997-05-06 US disclosed
WO-1997009311-A1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY F. HOFFMANN-LA ROCHE AG (CH) 1997-03-13 WO disclosed
US-5167693-A Pre- and postemergence BAYER AKTIENGESELLSCHAFT (DE) 1992-12-01 US disclosed
EP-0435104-A2 Salicylic acid derivatives, process for their preparation and their use as herbicide and bioregulators BASF Aktiengesellschaft (DE) 1991-07-03 EP 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 (1 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-20060079533-A1 Methods of treating alzheimer's disease BACE1, PSEN1, PSEN2 KMT2A 2702/4885LMNA 380/4885SMN1; SMN2 1096/4885

“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.