SCHEMBL8091350

SCHEMBL8091350

CN(C)C(=O)N(C)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.47
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
GPBAR1 Q8TDU6 1/20 0.43
ALDH1A1 P00352 4/20 0.40
TSHR P16473 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
MCHR1 Q99705 1/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
EPHX1 P07099 1/20 0.37
EPHX2 P34913 1/20 0.37
LMNA P02545 1/20 0.37
FSCN1 Q16658 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
SCHEMBL12550528 0.85 CYP3A4 (0.44) APEX1HDAC3HDAC1HDAC2HDAC6
SCHEMBL11815109 0.83 APEX1 (0.46) APEX1HDAC3HDAC1HDAC2HDAC6
SCHEMBL11722664 0.82 APEX1 (0.44) APEX1HDAC3HDAC1HDAC2HDAC6
SCHEMBL10865877 0.82 FSCN1 (0.50) APEX1HDAC3HDAC1HDAC2HDAC6
SCHEMBL2095708 0.82 APEX1 (0.44) APEX1HDAC3HDAC1HDAC2HDAC6
SCHEMBL1324846 0.82 TSHR (0.45) APEX1HDAC3HDAC1HDAC2HDAC6
SCHEMBL3191479 0.82 TSHR (0.50) ALDH1A1TSHRNR1H4SMN1; SMN2LMNA
SCHEMBL11517542 0.82 APEX1 (0.42) APEX1HDAC3HDAC1HDAC2HDAC6
SCHEMBL11257421 0.81 APEX1 (0.45) APEX1HDAC3HDAC1HDAC2HDAC6
SCHEMBL7564060 0.81 ALDH1A1 (0.36) APEX1GPBAR1ALDH1A1NR1H4SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7645903-B2 immunoglobulins; affinity chromatography GE HEALTHCARE BIO-SCIENCES AB (SE) 2010-01-12 US 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-4065292-A N-(3,4-DICHLOROPHENYL)-N',N'-DIMETHYL THIOUREA BAYER AKTIENGESELLSCHAFT (DT) 1977-12-27 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-4058525-A 4-Amino-5-thione-1,2,4-triazines BAYER AKTIENGESELLSCHAFT (DT) 1977-11-15 US disclosed
US-4057418-A Sulfonylmethylamino-substituted benzoic acids and herbicidal method therewith BAYER AKTIENGESELLSCHAFT (DT) 1977-11-08 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-3962307-A HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-06-08 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