SCHEMBL2708161

SCHEMBL2708161

CCCC(=O)Oc1ccc(Cl)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.56
CYP2C19 P33261 2/20 0.56
CYP2C9 P11712 1/20 0.56
MAPT P10636 2/20 0.54
TDP1 Q9NUW8 3/20 0.54
ALDH1A1 P00352 3/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
SMN1; SMN2 Q16637 3/20 0.51
ALOX15 P16050 1/20 0.51
HPGD P15428 3/20 0.50
TSHR P16473 3/20 0.50
KMT2A Q03164 3/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
MAPK1 P28482 1/20 0.49
NLRP1 Q9C000 1/20 0.49
CYP3A4 P08684 1/20 0.47
MEN1 O00255 1/20 0.47

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
SCHEMBL28921963 0.98 CYP1A2 (0.54) CYP1A2CYP2C19CYP2C9MAPTTDP1
Butyric Acid SCHEMBL28317751 0.94 TDP1 (0.53) CYP1A2CYP2C19CYP2C9MAPTTDP1
SCHEMBL645781 0.90 TDP1 (0.56) CYP1A2CYP2C19MAPTTDP1ALDH1A1
SCHEMBL27765388 0.89 MAPT (0.57) CYP1A2CYP2C19CYP2C9MAPTTDP1
SCHEMBL11221532 0.87 ALDH1A1 (0.48) CYP1A2CYP2C19CYP2C9MAPTTDP1
SCHEMBL9799896 0.86 L3MBTL1 (0.55) CYP1A2CYP2C19CYP2C9MAPTTDP1
SCHEMBL1678635 0.86 L3MBTL1 (0.55) CYP1A2CYP2C19CYP2C9MAPTTDP1
SCHEMBL3837266 0.85 CYP1A2 (0.54) CYP1A2CYP2C19CYP2C9MAPTTDP1
SCHEMBL27690790 0.84 MAPT (0.51) CYP1A2CYP2C19CYP2C9MAPTTDP1
SCHEMBL27614322 0.84 KMT2A (0.52) CYP1A2CYP2C19CYP2C9TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115536514-A Production process and system of 2, 4-D butyric acid 安徽兴隆化工有限公司 2022-12-30 CN claimed
EP-2104422-B1 OSTWALD RIPENING INHIBITION IN CHEMICAL FORMULATIONS HUNTSMAN PETROCHEMICAL LLC (US) 2018-09-05 EP claimed
EP-2445337-B1 HERBICIDAL CONCENTRATE COMPOSITIONS CONTAINING GLYPHOSATE AND DICAMBA SALTS DOW AGROSCIENCES LLC (US) 2018-04-18 EP claimed
US-20160143288-A1 HERBICIDAL CONCENTRATE COMPOSITIONS CONTAINING GLYPHOSATE AND DICAMBA SALTS DOW AGROSCIENCES LLC (US) 2016-05-26 US claimed
CN-102480936-B Herbicidal concentrate compositions containing glyphosate salt and dicamba salt DOW AGROSCIENCES LLC 2015-03-25 CN claimed
US-8232230-B2 Blend of chlorinated carboxylic acid herbicide and surfactant present in a quantity equal or greater than herbicide HELENA HOLDING COMPANY (US) 2012-07-31 US claimed
EP-2445337-A2 HERBICIDAL CONCENTRATE COMPOSITIONS CONTAINING GLYPHOSATE AND DICAMBA SALTS Dow AgroSciences LLC (US) 2012-05-02 EP claimed
US-20100331182-A1 HERBICIDAL CONCENTRATE COMPOSITIONS CONTAINING GLYPHOSATE AND DICAMBA SALTS DOW AGROSCIENCES LLC (US) 2010-12-30 US claimed
WO-2010151622-A2 HERBICIDAL CONCENTRATE COMPOSITIONS CONTAINING GLYPHOSATE AND DICAMBA SALTS DOW AGROSCIENCES LLC (US) 2010-12-29 WO claimed
EP-2161992-B1 ALKOXYLATED ASYMMETRIC ALKYLAMINE SURFACTANTS AS ADJUVANTS AKZO NOBEL NV (NL) 2010-11-17 EP claimed
US-20060030488-A1 Method of improving crop yields UNITED AGRI PRODUCTS 2006-02-09 US claimed
US-20050026780-A1 Manufacture and use of agricultural spray adjuvants for hard water conditions AGQUAM R&D, LLC 2005-02-03 US claimed
US-6831038-B2 Carboxylic acid or phosphorus-containing acid that is not a glyphosate, an amine-containing surfactant and a water soluble agricultural chemical; increasing the water solubility of agricultural compounds at low pH HELENA HOLDING COMPANY 2004-12-14 US claimed
US-20040167032-A1 Manufacture and use of a herbicide formulation VOLGAS GREG (US) 2004-08-26 US claimed
WO-2003103396-A1 MANUFACTURE AND USE OF A HERBICIDE FORMULATION HELENA CHEMICAL COMPANY RESEARCH EXTENSION AND SERVICE CENTER (US) 2003-12-18 WO claimed
US-20030140365-A1 Method of improving crop yields UNITED AGRI PRODUCTS 2003-07-24 US claimed
WO-2003034811-A2 METHOD OF IMPROVING CROP YIELDS UNITED AGRI PRODUCTS (US) 2003-05-01 WO claimed
US-20020160916-A1 Agricultural formulation HELENA AGRI-ENTERPRISES, LLC 2002-10-31 US claimed
US-20020107149-A1 Manufacture and use of a herbicide formulation HELENA AGRI-ENTERPRISES, LLC 2002-08-08 US claimed
US-4213776-A Herbicidal concentrate containing ketone and amide solvents UNIROYAL LTD. (CA) 1980-07-22 US claimed

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

For each of this compound's patents that has machine-readable text (3 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-20040167032-A1 Manufacture and use of a herbicide formulation DDT, HDHD5, SRM CYP1A2 286/4885CYP2C19 490/4885CYP2C9 87/4885
US-20020160916-A1 Agricultural formulation SRM, SLC7A5, SMS CYP1A2 1192/4885CYP2C19 1495/4885CYP2C9 890/4885
US-20020107149-A1 Manufacture and use of a herbicide formulation DDT, HDHD5, SRM CYP1A2 286/4885CYP2C19 490/4885CYP2C9 87/4885

“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.