SCHEMBL6994543

SCHEMBL6994543

CNc1nc2ncnn2c(C2CCCCC2)c1-c1c(F)cc(F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 18/20 0.39
MAPK1 P28482 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
SCHEMBL976565 0.85 PDE2A (0.43) PDE2AMAPK1
SCHEMBL6996976 0.83 PDE2A (0.39) PDE2A
SCHEMBL973762 0.83 PDE2A (0.41) PDE2A
SCHEMBL4480515 0.83 PDE2A (0.39) PDE2A
SCHEMBL7000544 0.82 PDE2A (0.39) PDE2A
SCHEMBL6994533 0.82 PDE2A (0.40) PDE2A
SCHEMBL6996525 0.79 PDE2A (0.38) PDE2A
SCHEMBL3227894 0.79 PDE2A (0.39) PDE2A
SCHEMBL6990103 0.76 PDE2A (0.40) PDE2A
SCHEMBL976541 0.75 MAPK1 (0.39) PDE2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054888-B1 FUNGICIDAL 7-ALKYL-TRIAZOLOPYRIMIDINES BASF AG (DE) 2003-11-26 EP claimed
US-6020338-A Fungicidal 7-alkyl-triazolopyrimidines AMERICAN CYANAMID COMPANY (US) 2000-02-01 US claimed
EP-1054888-B1 FUNGICIDAL 7-ALKYL-TRIAZOLOPYRIMIDINES BASF AG (DE) 2003-11-26 EP disclosed
EP-1359150-A2 A process and intermediates for the preparation of fungicidal 7-alkyl-triazolopyrimidines BASF AKTIENGESELLSCHAFT (DE) 2003-11-05 EP disclosed
EP-1054888-A1 FUNGICIDAL 7-ALKYL-TRIAZOLOPYRIMIDINES AMERICAN CYANAMID COMPANY (US) 2000-11-29 EP disclosed
US-6020338-A Fungicidal 7-alkyl-triazolopyrimidines AMERICAN CYANAMID COMPANY (US) 2000-02-01 US disclosed
WO-1999041255-A1 FUNGICIDAL 7-ALKYL-TRIAZOLOPYRIMIDINES AMERICAN CYANAMID COMPANY (US) 1999-08-19 WO disclosed