SCHEMBL4310083

SCHEMBL4310083

C=CCc1nc(N)c2[nH]nnc2n1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL325149 0.72 PDPK1 (0.54) —
SCHEMBL31561489 0.70 PDPK1 (0.45) —
SCHEMBL16336029 0.67 — —
SCHEMBL4940124 0.67 NPY5R (0.33) —
SCHEMBL8128978 0.67 — —
SCHEMBL4264379 0.65 — —
SCHEMBL456737 0.63 ALDH1A1 (0.33) —
SCHEMBL369674 0.63 CASP1 (0.40) —
SCHEMBL486583 0.63 CASP1 (0.46) —
Sulfuric Acid SCHEMBL3317386 0.62 PDPK1 (0.38) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7550471-B2 5-alkyl-7-aminotriazolopyrimidines, methods and intermediary product necessary for the production thereof, agents containing said compounds and the use thereof for fighting against harmful mushrooms BASF AKTIENGESELLSCHAFT (DE) 2009-06-23 — — US claimed
EP-1585747-B1 5-ALKYL-7-AMINOTRIAZOLOPYRIMIDINES, METHODS AND INTERMEDIATES SUITABLE FOR THEIR PRODUCTION, AGENTS CONTAINING THEM AND THEIR USE FOR CONTROLLING HARMFUL FUNGI BASF AG (DE) 2006-09-13 — — EP claimed
CN-1711263-A 5-alkyl-7-aminotriazolopyrimidines, methods and intermediary product necessary for the production thereof, agents containing said compounds and the use thereof for fighting against harmful mushrooms BASF AG (DE) 2005-12-21 — — CN claimed
US-20050272749-A1 5-Alkyl-7-aminotriazolopyrimidines, methods and intermediary product necessary for the production thereof, agents containing said compounds and the use thereof for fighting against harmful mushrooms BASF AKTIENGESELLSCHAFT (DE) 2005-12-08 — — US claimed
EP-1585747-A1 5-ALKYL-7-AMINOTRIAZOLOPYRIMIDINES, METHODS AND INTERMEDIARY PRODUCTS NECESSARY FOR THE PRODUCTION THEREOF, AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF FOR FIGHTING AGAINST HARMFUL MUSHROOMS BASF Aktiengesellschaft (DE) 2005-10-19 — — EP claimed
WO-2004041825-A1 5-ALKYL-7-AMINOTRIAZOLOPYRIMIDINES, METHODS AND INTERMEDIARY PRODUCTS NECESSARY FOR THE PRODUCTION THEREOF, AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF FOR FIGHTING AGAINST HARMFUL MUSHROOMS BASF AKTIENGESELLSCHAFT (DE) 2004-05-21 — — WO claimed
US-7550471-B2 5-alkyl-7-aminotriazolopyrimidines, methods and intermediary product necessary for the production thereof, agents containing said compounds and the use thereof for fighting against harmful mushrooms BASF AKTIENGESELLSCHAFT (DE) 2009-06-23 — — US disclosed
US-7550471-B2 5-alkyl-7-aminotriazolopyrimidines, methods and intermediary product necessary for the production thereof, agents containing said compounds and the use thereof for fighting against harmful mushrooms BASF AKTIENGESELLSCHAFT (DE) 2009-06-23 — — US disclosed
US-7550471-B2 5-alkyl-7-aminotriazolopyrimidines, methods and intermediary product necessary for the production thereof, agents containing said compounds and the use thereof for fighting against harmful mushrooms BASF AKTIENGESELLSCHAFT (DE) 2009-06-23 — — US disclosed
WO-2007113136-A1 USE OF SUBSTITUTED TRIAZOLOPYRIMIDINES FOR CONTROLLING PHYTOPATHOGENIC HARMFUL FUNGI BASF AKTIENGESELLSCHAFT (DE) 2007-10-11 — — WO disclosed
EP-1585747-B1 5-ALKYL-7-AMINOTRIAZOLOPYRIMIDINES, METHODS AND INTERMEDIATES SUITABLE FOR THEIR PRODUCTION, AGENTS CONTAINING THEM AND THEIR USE FOR CONTROLLING HARMFUL FUNGI BASF AG (DE) 2006-09-13 — — EP disclosed
EP-1585747-B1 5-ALKYL-7-AMINOTRIAZOLOPYRIMIDINES, METHODS AND INTERMEDIATES SUITABLE FOR THEIR PRODUCTION, AGENTS CONTAINING THEM AND THEIR USE FOR CONTROLLING HARMFUL FUNGI BASF AG (DE) 2006-09-13 — — EP disclosed
CN-1711263-A 5-alkyl-7-aminotriazolopyrimidines, methods and intermediary product necessary for the production thereof, agents containing said compounds and the use thereof for fighting against harmful mushrooms BASF AG (DE) 2005-12-21 — — CN disclosed
US-20050272749-A1 5-Alkyl-7-aminotriazolopyrimidines, methods and intermediary product necessary for the production thereof, agents containing said compounds and the use thereof for fighting against harmful mushrooms BASF AKTIENGESELLSCHAFT (DE) 2005-12-08 — — US disclosed
US-20050272749-A1 5-Alkyl-7-aminotriazolopyrimidines, methods and intermediary product necessary for the production thereof, agents containing said compounds and the use thereof for fighting against harmful mushrooms BASF AKTIENGESELLSCHAFT (DE) 2005-12-08 — — US disclosed
US-20050272749-A1 5-Alkyl-7-aminotriazolopyrimidines, methods and intermediary product necessary for the production thereof, agents containing said compounds and the use thereof for fighting against harmful mushrooms BASF AKTIENGESELLSCHAFT (DE) 2005-12-08 — — US disclosed
EP-1585747-A1 5-ALKYL-7-AMINOTRIAZOLOPYRIMIDINES, METHODS AND INTERMEDIARY PRODUCTS NECESSARY FOR THE PRODUCTION THEREOF, AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF FOR FIGHTING AGAINST HARMFUL MUSHROOMS BASF Aktiengesellschaft (DE) 2005-10-19 — — EP disclosed
EP-1585747-A1 5-ALKYL-7-AMINOTRIAZOLOPYRIMIDINES, METHODS AND INTERMEDIARY PRODUCTS NECESSARY FOR THE PRODUCTION THEREOF, AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF FOR FIGHTING AGAINST HARMFUL MUSHROOMS BASF Aktiengesellschaft (DE) 2005-10-19 — — EP disclosed
WO-2004041825-A1 5-ALKYL-7-AMINOTRIAZOLOPYRIMIDINES, METHODS AND INTERMEDIARY PRODUCTS NECESSARY FOR THE PRODUCTION THEREOF, AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF FOR FIGHTING AGAINST HARMFUL MUSHROOMS BASF AKTIENGESELLSCHAFT (DE) 2004-05-21 — — WO disclosed
WO-2004041825-A1 5-ALKYL-7-AMINOTRIAZOLOPYRIMIDINES, METHODS AND INTERMEDIARY PRODUCTS NECESSARY FOR THE PRODUCTION THEREOF, AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF FOR FIGHTING AGAINST HARMFUL MUSHROOMS BASF AKTIENGESELLSCHAFT (DE) 2004-05-21 — — WO disclosed
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