SCHEMBL14822754

SCHEMBL14822754

CCCN(COc1c(Cl)cc(Cl)cc1Cl)C(=O)n1ccnc1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.82
ADRB2 P07550 7/20 0.42
ADRB1 P08588 7/20 0.42
ADRB3 P13945 7/20 0.42
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
CRHR1 P34998 1/20 0.34
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HTT P42858 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
Prochloraz SCHEMBL22242 0.90 AHR (1.00) AHRADRB2ADRB1ADRB3KDM4E
Prochloraz SCHEMBL34675 0.90 AHR (1.00) AHRADRB2ADRB1ADRB3KDM4E
Prochloraz SCHEMBL11376171 0.89 AHR (0.98) AHRADRB2ADRB1ADRB3KDM4E
Prochloraz SCHEMBL5454581 0.89 AHR (0.98) AHRADRB2ADRB1ADRB3KDM4E
Prochloraz SCHEMBL9354846 0.89 AHR (0.98) AHRADRB2ADRB1ADRB3KDM4E
Prochloraz SCHEMBL12611119 0.89 AHR (0.98) AHRADRB2ADRB1ADRB3KDM4E
Prochloraz SCHEMBL9371936 0.89 AHR (0.98) AHRADRB2ADRB1ADRB3KDM4E
Prochloraz SCHEMBL11375792 0.89 AHR (0.98) AHRADRB2ADRB1ADRB3KDM4E
Prochloraz SCHEMBL11379280 0.89 AHR (0.98) AHRADRB2ADRB1ADRB3KDM4E
Prochloraz SCHEMBL11381653 0.89 AHR (0.98) AHRADRB2ADRB1ADRB3KDM4E

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-8410021-B2 Compositions for the control of plant pests BAYER CROPSCIENCE AG (DE) 2013-04-02 US disclosed