Sugi Predict

Sugi Predict / Compounds / Pirimiphos-Ethyl

Pirimiphos-Ethyl

Pirimiphos-Ethyl

SCHEMBL1070835

CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1.CCOP(=S)(OCC)Oc1cc(C)nc(N(C)C)n1.CCOP(=S)(OCC)Oc1cc(C)nc(N(CC)C(C)=O)n1.CCOP(=S)(OCC)Oc1cc(C)nc(N(CC)CC)n1.CCOc1cc(OP(=S)(OC)OC)nc(C(C)C)n1

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.55
▸ TSHR P16473 2/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ TP53 P04637 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ ACHE P22303 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ KMT2A Q03164 2/20 0.33
▸ MAPT P10636 1/20 0.32
▸ POLQ O75417 1/20 0.31

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
Pirimiphos-Ethyl SCHEMBL5266465 0.91 TDP1 (0.66) TDP1TSHRALDH1A1TP53CYP3A4
Pirimiphos Methyl SCHEMBL7081499 0.88 TDP1 (0.71) TDP1TSHRALDH1A1TP53CYP3A4
Tebupirimfos SCHEMBL1275729 0.82 TDP1 (0.49) TDP1TSHRALDH1A1TP53CYP3A4
SCHEMBL120557 0.80 TDP1 (0.69) TDP1TSHRALDH1A1TP53CYP3A4
Pirimiphos-Ethyl SCHEMBL15347188 0.78 TDP1 (0.90) TDP1TSHRALDH1A1TP53CYP3A4
Pirimiphos-Ethyl SCHEMBL1276210 0.77 TDP1 (0.52) TDP1TSHRALDH1A1TP53CYP3A4
Dimpylate SCHEMBL9686820 0.76 ALDH1A1 (0.71) TDP1TSHRALDH1A1TP53CYP3A4
SCHEMBL13598679 0.75 TDP1 (0.87) TDP1TSHRALDH1A1TP53CYP3A4
Dimpylate SCHEMBL28276693 0.74 ALDH1A1 (0.87) TDP1TSHRALDH1A1TP53CYP3A4
Pyrimitate SCHEMBL7870561 0.74 TDP1 (0.68) TDP1TSHRALDH1A1TP53CYP3A4

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-2268138-A2 SILICON DIOXIDE DISPERSION Evonik Degussa GmbH (DE) 2011-01-05 — — EP disclosed
WO-2009095141-A2 SILICON DIOXIDE DISPERSION EVONIK DEGUSSA GMBH (DE) 2009-08-06 — — WO disclosed