SCHEMBL6791055

SCHEMBL6791055

O=C(NO)Nc1ccc(Cl)c(Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 1.00
CA4 P22748 1/20 1.00
CA5A P35218 1/20 1.00
CA9 Q16790 1/20 1.00
EPHX1 P07099 2/20 0.81
EPHX2 P34913 2/20 0.81
MEN1 O00255 4/20 0.70
KMT2A Q03164 4/20 0.70
NPC1 O15118 3/20 0.70
LMNA P02545 1/20 0.70
ADORA3 P0DMS8 1/20 0.70
CHRM1 P11229 1/20 0.70
SLC6A2 P23975 1/20 0.70
PDE4A P27815 1/20 0.70
ADRA1A P35348 1/20 0.70
OPRM1 P35372 1/20 0.70
HTT P42858 1/20 0.70
PDE3A Q14432 1/20 0.70
NLRP3 Q96P20 1/20 0.70
P2RY1 P47900 1/20 0.68

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
SCHEMBL2683478 0.90 EPHX1 (1.00) CA2CA4CA5ACA9EPHX1
SCHEMBL30640703 0.90 EPHX1 (1.00) CA2CA4CA5ACA9EPHX1
Triclocarban SCHEMBL30479188 0.82 MEN1 (1.00) CA2CA4CA5ACA9EPHX1
SCHEMBL9202790 0.82 EPHX1 (0.78) CA2CA4CA5ACA9EPHX1
Triclocarban SCHEMBL27313500 0.82 MEN1 (1.00) CA2CA4CA5ACA9EPHX1
SCHEMBL2893642 0.82 EPHX1 (0.78) CA2CA4CA5ACA9EPHX1
Triclocarban SCHEMBL4978963 0.82 MEN1 (1.00) CA2CA4CA5ACA9EPHX1
Triclocarban SCHEMBL68658 0.82 MEN1 (1.00) CA2CA4CA5ACA9EPHX1
SCHEMBL30876298 0.82 EPHX1 (0.78) CA2CA4CA5ACA9EPHX1
SCHEMBL1877660 0.81 EPHX1 (0.81) CA2CA4CA5ACA9EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101781236-B Method for preparing 3-(3,4-dichlorophenyl)-1-methoxy-1-methyl urea JIANGSU KUAIDA AGROCHEMICAL CO LTD 2012-10-31 CN disclosed
CN-101781236-A Method for preparing 3-(3,4-dichlorophenyl)-1-methoxy-1-methyl urea JIANGSU KUAIDA AGROCHEMICAL CO 2010-07-21 CN disclosed
US-6713629-B2 PLANT FUNGICIDE NIPPON SODA CO., LTD. (JP) 2004-03-30 US disclosed
US-4193922-A HERBICIDES, FUNGICIDES ESZAKMAGYARORSZAGI VEGYIMUVEK (HU) 1980-03-18 US disclosed
US-3933507-A LIGHT INSENSITIVE SILVER SALT, POLYMETHINE SENSITIZER AGFA-GEVAERT, A.G. (DT) 1976-01-20 US disclosed