SCHEMBL904387

SCHEMBL904387

CN(C)C(=O)Nc1ccc(S(=O)(=O)NC(=O)c2cccc3ccccc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
DEGS1 O15121 1/20 0.50
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
PLK1 P53350 1/20 0.46
NR1H4 Q96RI1 1/20 0.45
BCL2L1 Q07817 2/20 0.44
BAK1 Q16611 2/20 0.44
FLT1 P17948 2/20 0.44
FLT4 P35916 2/20 0.44
KDR P35968 2/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL10223118 0.86 NPC1 (0.56) BDKRB1NPC1RAB9ADEGS1MEN1
SCHEMBL9468135 0.84 PLK1 (0.54) BDKRB1NPC1RAB9ADEGS1MEN1
SCHEMBL15624637 0.84 FLT1 (0.64) BDKRB1NPC1RAB9ACA12CA1
SCHEMBL29419094 0.81 RXFP1 (0.57) BDKRB1RAB9AMEN1KMT2ACA12
SCHEMBL341519 0.81 RXFP1 (0.57) BDKRB1RAB9AMEN1KMT2ACA12
SCHEMBL9177675 0.81 POLB (0.66) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL29578059 0.81 KMT2A (0.72) BDKRB1RAB9AMEN1KMT2ACA12
SCHEMBL340917 0.81 KMT2A (0.72) BDKRB1RAB9AMEN1KMT2ACA12
SCHEMBL9182039 0.80 KDM4E (0.64) DEGS1LMNAPLK1BCL2L1BAK1
SCHEMBL9967799 0.80 BDKRB1 (0.62) BDKRB1MEN1KMT2ACA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1453378-B1 HERBICIDAL AGENTS CONTAINING BENZOYLPYRAZOLES AND SAFENERS BAYER CROPSCIENCE GMBH (DE) 2006-08-23 EP claimed
EP-1213966-B1 NEW HERBICIDAL COMPOSITIONS BAYER CROPSCIENCE LTD (GB) 2006-04-19 EP claimed
EP-1383382-B1 HERBICIDAL AGENT COMPRISING BENZOYLCYCLOHEXANEDIONES AND SAFENERS BAYER CROPSCIENCE GMBH (DE) 2006-03-08 EP claimed
US-20060030485-A1 Herbicide/safener combinations AVENTIS CROPSCIENCE GMBH 2006-02-09 US claimed
US-20050148471-A1 Herbicidal compositions comprising benzoylpyrazoles and safeners BAYER CROPSCIENCE GMBH (DE) 2005-07-07 US claimed
EP-1130965-B1 COMBINATIONS OF HERBICIDES AND SAFENERS BAYER CROPSCIENCE GMBH (DE) 2003-10-29 EP claimed
US-20030171220-A1 Combinations of herbicides and safeners BAYER INTELLECTUAL PROPERTY GMBH (DE) 2003-09-11 US claimed
US-20030158039-A1 Herbicidal compositions comprising benzoylpyrazoles and safeners BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-08-21 US claimed
US-20030078167-A1 Herbicides comprising benzoylcyclohexanediones and safeners BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-04-24 US claimed
CN-1326317-A Combinations of herbicides and safeners AVENTIS CROPSCIENCE GMBH (DE) 2001-12-12 CN claimed
US-5541148-A USED WITH AGRICULTURAL CEREAL CROPS CIBA-GEIGY CORPORATION (US) 1996-07-30 US claimed
US-10159249-B2 Use of 2-chloro-3-(methylsulfanyl)-N-(1-methyl-1H-tetrazol-5-yl)-4-(trifluoromethyl)benzamide or its salts for controlling unwanted plants in areas of transgenic crop plants being tolerant to HPPD inhibitor herbicides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-12-25 US disclosed
US-10021877-B2 Substituted 5-hydroxy-2,3-diphenylpentanonitrile derivatives, processes for their preparation and their use as herbicides and/or plant growth regulators BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-07-17 US disclosed
EP-3003036-B1 SUBSTITUTED 5-HYDROXY-2,3-DIPHENYLPENTANONITRILE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES AND/OR PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2018-04-11 EP disclosed
US-9920383-B2 Active substances for increasing the stress defense in plants to abiotic stress, and methods of finding them BAYER INTELLECTUAL PROPERTY GMBH (DE) 2018-03-20 US disclosed
CN-1326317-A Combinations of herbicides and safeners AVENTIS CROPSCIENCE GMBH (DE) 2001-12-12 CN disclosed
CN-1326317-A Combinations of herbicides and safeners AVENTIS CROPSCIENCE GMBH (DE) 2001-12-12 CN disclosed
EP-1130965-A1 COMBINATIONS OF HERBICIDES AND SAFENERS Aventis CropScience GmbH (DE) 2001-09-12 EP disclosed
WO-2001017350-A1 NEW HERBICIDAL COMPOSITIONS AVENTIS CROPSCIENCE UK LIMITED (GB) 2001-03-15 WO disclosed
WO-2000030447-A1 COMBINATIONS OF HERBICIDES AND SAFENERS AVENTIS CROPSCIENCE GMBH (DE) 2000-06-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060030485-A1 Herbicide/safener combinations DDT, DERL1, SLC16A7 BDKRB1 3975/4885NPC1 4521/4885RAB9A 2617/4885
US-20030171220-A1 Combinations of herbicides and safeners DDT, CYP2B6, CYP2A6 BDKRB1 4198/4885NPC1 4504/4885RAB9A 3200/4885
US-20030158039-A1 Herbicidal compositions comprising benzoylpyrazoles and safeners DDT, CYP4Z1, HDHD5 BDKRB1 3918/4885NPC1 4464/4885RAB9A 2924/4885
US-20030078167-A1 Herbicides comprising benzoylcyclohexanediones and safeners DDT, HPD, HDHD5 BDKRB1 2488/4885NPC1 4730/4885RAB9A 4476/4885
US-10021877-B2 Substituted 5-hydroxy-2,3-diphenylpentanonitrile derivatives, processes for their preparation and their use as herbicides and/or plant growth regulators HPD, DDT, HDHD5 BDKRB1 4043/4885NPC1 4858/4885RAB9A 4077/4885
US-10159249-B2 Use of 2-chloro-3-(methylsulfanyl)-N-(1-methyl-1H-tetrazol-5-yl)-4-(trifluoromethyl)benzamide or its salts for controlling unwanted plants in areas of transgenic crop plants being tolerant to HPPD inhibitor herbicides HPD, PGD, PHYKPL BDKRB1 3670/4885NPC1 3329/4885RAB9A 4256/4885
US-20050148471-A1 Herbicidal compositions comprising benzoylpyrazoles and safeners DDT, HDHD5, CYP4Z1 BDKRB1 2968/4885NPC1 4637/4885RAB9A 3397/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.