SCHEMBL8276282

SCHEMBL8276282

[C-]#[N+]c1ncn(C[C@@H](C)O)c1N

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.47
ADORA1 P30542 2/20 0.47
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.33
ADORA2B P29275 1/20 0.32
POLB P06746 1/20 0.31
AHCY P23526 1/20 0.31
CCNE1 P24864 1/20 0.30
CDK2 P24941 1/20 0.30

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
SCHEMBL8276285 1.00 ADORA2A (0.47) ADORA2AADORA1LMNASMN1; SMN2KDM4E
SCHEMBL8465291 0.71 ADORA2A (0.47) ADORA2AADORA1LMNASMN1; SMN2KDM4E
SCHEMBL8465200 0.71 ADORA2A (0.47) ADORA2AADORA1LMNASMN1; SMN2KDM4E
SCHEMBL6024012 0.71 LMNA (0.49) ADORA2AADORA1LMNASMN1; SMN2KDM4E
SCHEMBL1393316 0.64 ADORA2A (1.00) ADORA2AADORA1ADORA2BAHCY
SCHEMBL904363 0.64 ADORA2A (1.00) ADORA2AADORA1ADORA2BAHCY
SCHEMBL5810639 0.64 ADORA2A (1.00) ADORA2AADORA1ADORA2BAHCY
SCHEMBL29496348 0.64 ADORA2A (1.00) ADORA2AADORA1ADORA2BAHCY
SCHEMBL20986028 0.62 ADORA2A (0.51) ADORA2AADORA1LMNASMN1; SMN2KDM4E
SCHEMBL20986040 0.62 ADORA2A (0.44) ADORA2AADORA1LMNASMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8785654-B2 Method for production of N-(2-amino-1,2-dicyanovinyl)imidates, method for production of N-(2-amino-1,2-dicyanovinyl)formamidine, and method for production of aminoimidazole derivatives NIPPON SODA CO., LTD. (JP) 2014-07-22 US disclosed
US-8273899-B2 Method for production of N-(2-amino-1,2-dicyanovinyl)imidates, method for production of N-(2-amino-1,2-dicyanovinyl)formamidine, and method for production of aminoimidazole derivatives NIPPON SODA CO., LTD. (JP) 2012-09-25 US disclosed
US-8258333-B2 Method for production of N-(2-amino-1,2-dicyanovinyl)imidates, method for production of N-(2-amino-1,2-dicyanovinyl)formamidine, and method for production of aminoimidazole derivatives NIPPON SODA CO., LTD. (JP) 2012-09-04 US disclosed
US-20120142957-A1 METHOD FOR PRODUCTION OF N-(2-AMINO-1,2-DICYANOVINYL)IMIDATES, METHOD FOR PRODUCTION OF N-(2-AMINO-1,2-DICYANOVINYL)FORMAMIDINE, AND METHOD FOR PRODUCTION OF AMINOIMIDAZOLE DERIVATIVES NIPPON SODA CO., LTD. (JP) 2012-06-07 US disclosed
US-20120130083-A1 METHOD FOR PRODUCTION OF N-(2-AMINO-1,2-DICYANOVINYL)IMIDATES, METHOD FOR PRODUCTION OF N-(2-AMINO-1,2-DICYANOVINYL)FORMAMIDINE, AND METHOD FOR PRODUCTION OF AMINOIMIDAZOLE DERIVATIVES NIPPON SODA CO., LTD. (JP) 2012-05-24 US disclosed
US-20100087655-A1 METHOD FOR PRODUCTION OF N-(2-AMINO-1,2-DICYANOVINYL)IMIDATES, METHOD FOR PRODUCTION OF N-(2-AMINO-1,2-DICYANOVINYL)FORMAMIDINE, AND METHOD FOR PRODUCTION OF AMINOIMIDAZOLE DERIVATIVES NIPPON SODA CO., LTD (JP) 2010-04-08 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 (3 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-20100087655-A1 METHOD FOR PRODUCTION OF N-(2-AMINO-1,2-DICYANOVINYL)IMIDATES, METHOD FOR PRODUCTION OF N-(2-AMINO-1,2-DICYANOVINYL)FORMAMIDINE, AND METHOD FOR PRODUCTION OF AMINOIMIDAZOLE DERIVATIVES NAAA, ITPA, GART ADORA2A 609/4885ADORA1 604/4885LMNA 1944/4885
US-20120142957-A1 METHOD FOR PRODUCTION OF N-(2-AMINO-1,2-DICYANOVINYL)IMIDATES, METHOD FOR PRODUCTION OF N-(2-AMINO-1,2-DICYANOVINYL)FORMAMIDINE, AND METHOD FOR PRODUCTION OF AMINOIMIDAZOLE DERIVATIVES NIT2, NPM1, NAT1 ADORA2A 2521/4885ADORA1 1346/4885LMNA 2328/4885
US-20120130083-A1 METHOD FOR PRODUCTION OF N-(2-AMINO-1,2-DICYANOVINYL)IMIDATES, METHOD FOR PRODUCTION OF N-(2-AMINO-1,2-DICYANOVINYL)FORMAMIDINE, AND METHOD FOR PRODUCTION OF AMINOIMIDAZOLE DERIVATIVES NCL, NCLN, NIT2 ADORA2A 2214/4885ADORA1 1667/4885LMNA 805/4885

“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.