SCHEMBL8090741

SCHEMBL8090741

Cc1ccc(Cl)c(Cl)c1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.48
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 2/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPK1 P28482 2/20 0.42
MEN1 O00255 1/20 0.42
AKR1B10 O60218 1/20 0.42
ABCB11 O95342 1/20 0.42
TTR P02766 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CHRM1 P11229 1/20 0.42
FABP2 P12104 1/20 0.42
RXRA P19793 1/20 0.42
TBXA2R P21731 1/20 0.42
NR4A1 P22736 1/20 0.42
PTGS1 P23219 1/20 0.42
PDE4A P27815 1/20 0.42
PTGS2 P35354 1/20 0.42
AKR1C3 P42330 1/20 0.42
NR4A2 P43354 1/20 0.42

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
SCHEMBL27511348 0.86 ALDH1A1 (0.45) DPP4ALDH1A1KDM4EHSD17B10MAPK1
SCHEMBL7744335 0.83 ALDH1A1 (0.46) DPP4ALDH1A1KDM4EHSD17B10MAPK1
SCHEMBL4638190 0.83 ALDH1A1 (0.52) DPP4ALDH1A1KDM4EHSD17B10MAPK1
SCHEMBL11216806 0.83 DPP4 (0.54) DPP4ALDH1A1KDM4EHSD17B10MAPK1
2,3,6-Trichlorobenzoic Acid SCHEMBL117071 0.81 DPP4 (0.62) DPP4ALDH1A1KDM4EHSD17B10MAPK1
2,3,6-Trichlorobenzoic Acid SCHEMBL29365114 0.81 DPP4 (0.62) DPP4ALDH1A1KDM4EHSD17B10MAPK1
SCHEMBL22993172 0.81 DPP4 (0.47) DPP4ALDH1A1KDM4EHSD17B10MAPK1
SCHEMBL28759223 0.81 DPP4 (0.69) DPP4ALDH1A1KDM4EHSD17B10MAPK1
SCHEMBL31159145 0.81 DPP4 (0.47) DPP4ALDH1A1KDM4EHSD17B10MAPK1
SCHEMBL27289072 0.81 TSHR (0.45) ALDH1A1KDM4EHSD17B10MAPK1MEN1

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 109 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106588601-A Method of 3, 4 -dichlorotoluene continually preparing 3, 4- dichlorobenzaldehyde 常州大学 2017-04-26 CN disclosed
US-6117821-A COMPRISING HERBICIDES AND AGRONOMICALLY ACCEPTABLE CARRIERS; USE THEREOF AS BROAD SPECTRUM HERBICIDES WHICH ARE EFFECTIVE AGAINST BOTH MONOCOT AND DICOT WEED SPECIES IN BOTH PREEMERGENCE AND POSTEMERGENCE APPLICATIONS ROHM AND HAAS COMPANY (US) 2000-09-12 US disclosed
US-6025301-A BROAD SPECTRUM HERBICIDES EFFECTIVE AGAINST BOTH MONOCOT AND DICOT WEED SPECIES IN POSTEMERGENCE APPLICATIONS ROHM AND HAAS COMPANY (US) 2000-02-15 US disclosed
US-5883044-A Herbicidal method utilizing phosphosulfonate herbicides and oxime ether safeners ROHM AND HAAS COMPANY (US) 1999-03-16 US disclosed
US-5866513-A Aryl-substituted cycloalkanes and cycloalkenes and herbicidal use thereof ROHM AND HAAS COMPANY (US) 1999-02-02 US disclosed
EP-0699390-B1 Compositions containing phosphosulfonate herbicides and dichloroacetamide safeners, and method of use ROHM & HAAS (US) 1998-10-07 EP disclosed
EP-0862860-A2 Indanone herbicide compositions and use thereof ROHM AND HAAS COMPANY (US) 1998-09-09 EP disclosed
US-5733849-A Halopyridyl triazolinone herbicides and herbicidal use thereof ROHM AND HAAS COMPANY (US) 1998-03-31 US disclosed
US-5726124-A IN MIXTURE WITH OTHER HERBICIDES, ALKYLATION AND ETHERIFICATION OF PYRIMIDINONE AND THIOPYRIMIDINONE COMPOUNDS ROHM AND HAAS COMPANY (US) 1998-03-10 US disclosed
US-5723414-A APPLYING TO WEEDS ROHM AND HAAS COMPANY (US) 1998-03-03 US disclosed
US-4083713-A CONTROLLING WEEDS ROHM AND HAAS COMPANY (US) 1978-04-11 US disclosed
US-4082538-A HERBICIDES FOR MONOCOTYLEDONS AND DICOTYLEDONS ROHM AND HAAS COMPANY (US) 1978-04-04 US disclosed
US-4076741-A Herbicidal 4-trifluoromethyl-4-nitrodiphenyl ethers ROHM AND HAAS COMPANY (US) 1978-02-28 US disclosed
US-4070178-A Herbicidal diphenyl ethers ROHM AND HAAS COMPANY (US) 1978-01-24 US disclosed
US-4063929-A Herbicidal 4-trifluoromethyl-4'nitrodiphenyl ethers ROHM AND HAAS COMPANY (US) 1977-12-20 US disclosed
US-4059435-A Herbicidal 4-trifluoromethyl-3-cyanoalkoxy-4-nitro diphenyl ethers ROHM AND HAAS COMPANY (US) 1977-11-22 US disclosed
US-4046798-A Herbicidal 4-trifluoromethyl-4'nitrodiphenyl ethers ROHM AND HAAS COMPANY (US) 1977-09-06 US disclosed
US-4039588-A ALKOXY, AMINO, HALO-, OR CYANO-SUBSTITUTED ROHM AND HAAS COMPANY (US) 1977-08-02 US disclosed
US-3954875-A Benzophenone herbicides ROHM AND HAAS COMPANY (US) 1976-05-04 US disclosed
US-3950379-A HERBICIDES ROHM AND HAAS COMPANY (US) 1976-04-13 US disclosed