SCHEMBL584580

SCHEMBL584580

Cc1ncc(C#N)c(N)n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1A1 P48729 1/20 0.60
CLK4 Q9HAZ1 1/20 0.60
KDM4E B2RXH2 4/20 0.46
GAA P10253 3/20 0.46
KMT2A Q03164 3/20 0.46
HSD17B10 Q99714 3/20 0.46
TSHR P16473 2/20 0.46
MEN1 O00255 1/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TP53 P04637 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
ALDH1A1 P00352 4/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
USP2 O75604 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL15434635 0.78 CSNK1A1 (0.39) CSNK1A1CLK4KDM4EGAAKMT2A
SCHEMBL263835 0.78 CSNK1A1 (0.64) CSNK1A1CLK4KDM4EGAAKMT2A
SCHEMBL14932504 0.75 CSNK1A1 (0.37) CSNK1A1CLK4KDM4EGAAKMT2A
SCHEMBL12726137 0.75 CSNK1A1 (0.46) CSNK1A1CLK4KDM4ETSHRL3MBTL1
SCHEMBL12726136 0.75 CSNK1A1 (0.37) CSNK1A1CLK4KDM4EGAAKMT2A
SCHEMBL1143429 0.75 CSNK1A1 (1.00) CSNK1A1CLK4KDM4EGAAKMT2A
SCHEMBL19837459 0.75 CSNK1A1 (0.60) CSNK1A1CLK4KDM4EGAAKMT2A
SCHEMBL1143690 0.75 CSNK1A1 (0.60) CSNK1A1CLK4KDM4EGAAKMT2A
SCHEMBL28939398 0.75 CSNK1A1 (0.60) CSNK1A1CLK4KDM4EGAAKMT2A
SCHEMBL31492947 0.75 CSNK1A1 (0.60) CSNK1A1CLK4KDM4EGAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119751436-A Method for efficiently preparing vitamin B1 云鹏医药集团有限公司 2025-04-04 CN claimed
CN-112851588-B Micro-reaction system and method for continuously preparing 2-methyl-4-amino-5-cyanopyrimidine by using same 复旦大学 2023-04-21 CN claimed
US-11554355-B2 Micro reaction system and method for preparing 2-methyl-4-amino-5-cyanopyrimidine using same FUDAN UNIVERSITY (CN) 2023-01-17 US claimed
US-11554356-B2 Full continuous flow preparation method of 2-methyl-4-amino-5-aminomethylpyrimidine FUDAN UNIVERSITY (CN) 2023-01-17 US claimed
US-11554354-B2 Micro-reaction system and method for preparing 2-methyl-4-amino-5-aminomethyl pyrimidine FUDAN UNIVERSITY (CN) 2023-01-17 US claimed
CN-112341395-B Micro-reaction system and method for continuously preparing 2-methyl-4-amino-5-aminomethyl pyrimidine by using same 复旦大学 2022-06-21 CN claimed
US-20210394150-A1 FULL CONTINUOUS FLOW PREPARATION METHOD OF 2-METHYL-4-AMINO-5-AMINOMETHYLPYRIMIDINE UNIV FUDAN (CN) 2021-12-23 US claimed
US-20210394148-A1 MICRO-REACTION SYSTEM AND METHOD FOR PREPARING 2-METHYL-4-AMINO-5-AMINOMETHYL PYRIMIDINE FUDAN UNIVERSITY (CN) 2021-12-23 US claimed
US-20210394149-A1 MICRO REACTION SYSTEM AND METHOD FOR PREPARING 2-METHYL-4-AMINO-5-CYANOPYRIMIDINE USING SAME FUDAN UNIVERSITY (CN) 2021-12-23 US claimed
CN-113121449-A Full continuous flow preparation method of 2-methyl-4-amino-5-aminomethyl pyrimidine 复旦大学 2021-07-16 CN claimed
CN-112851588-A Micro-reaction system and method for continuously preparing 2-methyl-4-amino-5-cyanopyrimidine by using same 复旦大学 2021-05-28 CN claimed
CN-112341395-A Micro-reaction system and method for continuously preparing 2-methyl-4-amino-5-aminomethyl pyrimidine by using same 复旦大学 2021-02-09 CN claimed
CN-111018836-A Pyrimidine preparation with synergistic sulfonamide effect and preparation method thereof 南京福斯特牧业科技有限公司 2020-04-17 CN claimed
CN-106279042-B The method for preparing 2- methyl -4- amino-5-cyanopyrimidine is reacted using Mannich 新发药业有限公司 2018-12-11 CN claimed
CN-106008363-B The preparation method of 2- methyl -4- amino-5-cyanopyrimidines 新发药业有限公司 2018-06-19 CN claimed
CN-105254574-B A kind of simple and convenient process for preparing of the cyanopyrimidine of 2 methyl of vitamin B1 key intermediate, 4 amino 5 新发药业有限公司 2017-11-14 CN claimed
CN-106279042-A The method utilizing Mannich reaction preparation 2 methyl 4 amino 5 cyanopyrimidines 新发药业有限公司 2017-01-04 CN claimed
CN-106008363-A Environment-friendly preparation method of 2-methyl-4-amino-5-cyanopyrimidine 新发药业有限公司 2016-10-12 CN claimed
CN-105254574-A Simple preparation method of vitamin B1 key intermediate 2-methyl-4-amidogen-5-cyanopyrimidine XINFA PHARMACEUTICAL CO LTD 2016-01-20 CN claimed
US-4256550-A ELECTROCHEMICAL OXIDATION AND REDUCTION TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-03-17 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-20210394148-A1 MICRO-REACTION SYSTEM AND METHOD FOR PREPARING 2-METHYL-4-AMINO-5-AMINOMETHYL PYRIMIDINE DPYD, HNMT, KIT CSNK1A1 3569/4885CLK4 1336/4885KDM4E 797/4885
US-20210394150-A1 FULL CONTINUOUS FLOW PREPARATION METHOD OF 2-METHYL-4-AMINO-5-AMINOMETHYLPYRIMIDINE MCM4, NUDT1, CMPK1 CSNK1A1 966/4885CLK4 67/4885KDM4E 287/4885
US-20210394149-A1 MICRO REACTION SYSTEM AND METHOD FOR PREPARING 2-METHYL-4-AMINO-5-CYANOPYRIMIDINE USING SAME DPYD, MCM4, UMPS CSNK1A1 3015/4885CLK4 299/4885KDM4E 950/4885
US-11554356-B2 Full continuous flow preparation method of 2-methyl-4-amino-5-aminomethylpyrimidine MCM4, NUDT1, CMPK1 CSNK1A1 966/4885CLK4 67/4885KDM4E 287/4885
US-11554355-B2 Micro reaction system and method for preparing 2-methyl-4-amino-5-cyanopyrimidine using same DPYD, MCM4, UMPS CSNK1A1 3015/4885CLK4 299/4885KDM4E 950/4885
US-11554354-B2 Micro-reaction system and method for preparing 2-methyl-4-amino-5-aminomethyl pyrimidine DPYD, HNMT, KIT CSNK1A1 3569/4885CLK4 1336/4885KDM4E 797/4885

“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.