SCHEMBL4666576

SCHEMBL4666576

CC1C2CN(c3c(-c4c(F)cccc4Cl)c(Cl)nc4ncnn34)CC12

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 10/20 0.40
TSHR P16473 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
GLA P06280 1/20 0.39
ALDH1A1 P00352 3/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL4665974 0.90 PDE2A (0.39) PDE2ATSHRNPSR1GLAALDH1A1
SCHEMBL4668079 0.87 PDE2A (0.39) PDE2ATSHRNPSR1GLAALDH1A1
SCHEMBL344327 0.86 TSHR (0.46) PDE2ATSHRNPSR1GLAALDH1A1
SCHEMBL4667784 0.84 GAA (0.35) PDE2ATSHRNPSR1GLAALDH1A1
SCHEMBL4820465 0.84 PDE2A (0.39) PDE2ATSHRNPSR1GLAALDH1A1
SCHEMBL8916197 0.84 PDE2A (0.39) PDE2ATSHRNPSR1GLAALDH1A1
SCHEMBL5180722 0.83 TSHR (0.38) PDE2ATSHRNPSR1GLAALDH1A1
SCHEMBL4667804 0.83 PDE2A (0.37) PDE2ATSHRNPSR1GLAALDH1A1
SCHEMBL4821568 0.82 ALDH1A1 (0.39) PDE2ATSHRNPSR1GLAALDH1A1
SCHEMBL4817293 0.82 TSHR (0.40) PDE2ATSHRNPSR1GLAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1980150-A1 Fungicidal mixtures based on triazolopyrimidine compounds BASF SE (DE) 2008-10-15 EP claimed
EP-1980150-A1 Fungicidal mixtures based on triazolopyrimidine compounds BASF SE (DE) 2008-10-15 EP disclosed
WO-2006100038-A1 TRIAZOLOPYRIMIDINE DERIVATIVES USEFUL AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2006-09-28 WO disclosed