SCHEMBL9860802

SCHEMBL9860802

CCc1ccccc1NC(=O)C(Cl)CC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.55
TAS1R1 Q7RTX1 1/20 0.55
POLB P06746 2/20 0.53
ALDH1A1 P00352 3/20 0.52
HTT P42858 2/20 0.51
KMT2A Q03164 3/20 0.50
GAA P10253 2/20 0.50
MEN1 O00255 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MAPT P10636 4/20 0.49
PKM P14618 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HDAC3 O15379 1/20 0.49
HDAC4 P56524 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
HDAC8 Q9BY41 1/20 0.49

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
SCHEMBL10584522 0.85 L3MBTL1 (0.58) TAS1R3TAS1R1POLBALDH1A1HTT
SCHEMBL11057176 0.83 PGR (0.57) POLBALDH1A1GAAMAPTTSHR
SCHEMBL13469120 0.82 L3MBTL1 (0.70) TAS1R3TAS1R1POLBALDH1A1HTT
SCHEMBL3469082 0.82 L3MBTL1 (0.41) TAS1R3TAS1R1POLBALDH1A1KMT2A
SCHEMBL5152296 0.81 KMT2A (0.63) TAS1R3TAS1R1POLBALDH1A1HTT
SCHEMBL29580443 0.80 HTT (0.72) TAS1R3TAS1R1POLBALDH1A1HTT
SCHEMBL9717979 0.80 HTT (0.72) TAS1R3TAS1R1POLBALDH1A1HTT
SCHEMBL10626890 0.79 TAS1R3 (0.54) TAS1R3TAS1R1POLBALDH1A1HTT
SCHEMBL6901453 0.77 MAPT (0.61) POLBALDH1A1HTTKMT2AGAA
SCHEMBL11741381 0.77 MAPT (0.56) TAS1R3TAS1R1POLBALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-87101526-A A kind of method of synthetic Butachlor technical 92 1988-11-23 CN claimed
CN-107868020-A A kind of preparation method of alachlor 安徽富田农化有限公司 2018-04-03 CN disclosed
CN-103122312-A Microorganism composition for degrading acetochlor and/or butachlor and application of microorganism composition UNIV NANJING AGRICULTURAL 2013-05-29 CN disclosed
EP-0223449-B1 METHOD OF WEED CONTROL USING DIFLUFENICAN MAY & BAKER LIMITED (GB) 1991-07-24 EP disclosed
US-5010191-A Chelated transition metal complexes THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1991-04-23 US disclosed
CN-87101526-A A kind of method of synthetic Butachlor technical 92 1988-11-23 CN disclosed
CN-87101526-A A kind of method of synthetic Butachlor technical 92 1988-11-23 CN disclosed
US-4561879-A Composition and method for combating weeds using an N-imidazolylmethyl halogenoacetanilide BAYER AKTIENGESELLSCHAFT (DE) 1985-12-31 US disclosed
US-4517011-A N-substituted halogenoacetanilides and their use as herbicides BAYER AKTIENGESELLSCHAFT (DE) 1985-05-14 US disclosed
EP-0010715-B1 N-ALKYL-HALOACETANILIDES SUBSTITUTED BY AN OXIME GROUP, PROCESSES FOR THEIR PREPARATION, HERBICIDAL COMPOSITIONS CONTAINING THEM, A PROCESS FOR COMBATING WEEDS, A PROCESS FOR PREPARING HERBICIDAL COMPOSITIONS. BAYER AG (DE) 1982-01-27 EP disclosed
US-4312664-A N,N-DIALLYL-DICHLOROACETAMIDE BAYER AKTIENGESELLSCHAFT (DE) 1982-01-26 US disclosed
EP-0010715-A1 N-alkyl-haloacetanilides substituted by an oxime group, processes for their preparation, herbicidal compositions containing them, a process for combating weeds, a process for preparing herbicidal compositions. BAYER AG (DE) 1980-05-14 EP disclosed
EP-0006541-A2 Use of N,N-diallyl-dichloroacetamide for improving the protection of crop plants against herbicidally active acetanilides BAYER AG (DE) 1980-01-09 EP disclosed
EP-0006542-A2 The use of N-dichloroacetyl-1,2,3,4-tetrahydroisoquinolin as antidote for the protection of cultivated plants against damage caused by herbicidally active acetanilides; combinations thus obtained and process for their preparation BAYER AG (DE) 1980-01-09 EP disclosed
EP-0006540-A1 N-Dichloroacetyl-1,2,3,4-tetrahydroquinaldine, process for obtaining it, its use for preventing crops from being damaged by herbicides and selective herbicidal compositions based on N-dichloroacetyl-1,2,3,4-tetrahydroquinaldine and herbicidal acetanilides or thiolcarbamates BAYER AG (DE) 1980-01-09 EP disclosed