SCHEMBL4668079

SCHEMBL4668079

Fc1cccc(Cl)c1-c1c(Cl)nc2ncnn2c1N1CC2CC2C1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 8/20 0.39
GLA P06280 1/20 0.36
TSHR P16473 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 3/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 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 0.94 PDE2A (0.39) PDE2AGLATSHRNPSR1ALDH1A1
SCHEMBL4666613 0.93 PDE2A (0.39) PDE2AGLATSHRNPSR1ALDH1A1
SCHEMBL4666576 0.87 PDE2A (0.40) PDE2AGLATSHRNPSR1ALDH1A1
SCHEMBL4820465 0.85 PDE2A (0.39) PDE2AGLATSHRNPSR1ALDH1A1
SCHEMBL8916197 0.85 PDE2A (0.39) PDE2AGLATSHRNPSR1ALDH1A1
SCHEMBL344327 0.84 TSHR (0.46) PDE2AGLATSHRNPSR1ALDH1A1
SCHEMBL4817293 0.84 TSHR (0.40) PDE2AGLATSHRNPSR1ALDH1A1
SCHEMBL5183058 0.84 PDE2A (0.37) PDE2AGLATSHRNPSR1ALDH1A1
SCHEMBL4818887 0.83 TSHR (0.37) PDE2AGLATSHRNPSR1ALDH1A1
SCHEMBL4810483 0.83 TSHR (0.48) PDE2AGLATSHRNPSR1ALDH1A1

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 2 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 disclosed
WO-2006100038-A1 TRIAZOLOPYRIMIDINE DERIVATIVES USEFUL AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2006-09-28 WO disclosed