Penconazole

Penconazole

SCHEMBL8050480

CCCC(Cn1cncn1)c1ccc(Cl)cc1Cl.CCCC(Cn1cncn1)c1ccc(Cl)cc1Cl.CCCC(Cn1cncn1)c1ccc(Cl)cc1Cl

nearest known ligand 0.56

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.41
CYP3A4 P08684 5/20 0.41
THRB P10828 1/20 0.41
ADRA2C P18825 2/20 0.40
LMNA P02545 1/20 0.39
PKM P14618 1/20 0.39
POLB P06746 2/20 0.39
CYP2C9 P11712 3/20 0.37
CYP1A2 P05177 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C19 P33261 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
USP2 O75604 1/20 0.37
ALOX15 P16050 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NR1I2 O75469 1/20 0.37
NR3C1 P04150 1/20 0.37
FYN P06241 1/20 0.37

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
Penconazole SCHEMBL29416459 1.00 CYP19A1 (0.41) CYP19A1CYP3A4THRBADRA2CLMNA
Penconazole SCHEMBL30015079 1.00 CYP19A1 (0.41) CYP19A1CYP3A4THRBADRA2CLMNA
Penconazole SCHEMBL3003031 1.00 CYP19A1 (0.41) CYP19A1CYP3A4THRBADRA2CLMNA
Penconazole SCHEMBL24791 1.00 CYP19A1 (0.41) CYP19A1CYP3A4THRBADRA2CLMNA
SCHEMBL9480900 0.93 CYP3A4 (0.40) CYP19A1CYP3A4THRBADRA2CLMNA
SCHEMBL10833284 0.91 CYP3A4 (0.39) CYP19A1CYP3A4THRBADRA2CLMNA
SCHEMBL10364855 0.90 CYP19A1 (0.43) CYP19A1CYP3A4THRBADRA2CLMNA
Alcohol SCHEMBL27859648 0.89 CYP3A4 (0.39) CYP19A1CYP3A4THRBADRA2CLMNA
SCHEMBL10978037 0.89 CYP19A1 (0.46) CYP19A1CYP3A4THRBADRA2CLMNA
SCHEMBL18121996 0.88 MEN1 (0.33) CYP19A1CYP3A4THRBPOLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6069302-A Hybrid spring oilseed Brassica napus with winter germplasm introgression WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2000-05-30 US disclosed