SCHEMBL8918684

SCHEMBL8918684

C[C@@H](Oc1ccc2ccc(Oc3ccc(C(F)(F)F)cc3Cl)cc2c1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.58
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
TTR P02766 1/20 0.52
PPOX P50336 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
PTGDR2 Q9Y5Y4 4/20 0.48
HTR2A P28223 2/20 0.45
SLC6A4 P31645 2/20 0.45
KCNH2 Q12809 2/20 0.45
MRGPRX4 Q96LA9 3/20 0.43
ABCB11 O95342 1/20 0.42
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41

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
SCHEMBL204622 1.00 FFAR1 (0.58) FFAR1MEN1KMT2ATTRPPOX
Hydrochloric Acid SCHEMBL10642889 0.99 FFAR1 (0.57) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL10642883 0.91 FFAR1 (0.53) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL9420232 0.91 FFAR1 (0.67) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL10644341 0.90 FFAR1 (0.52) FFAR1MEN1KMT2ATTRPPOX
Hydrochloric Acid SCHEMBL10942896 0.90 FFAR1 (0.65) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL941173 0.89 FFAR1 (0.51) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL29382403 0.89 FFAR1 (0.51) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL147772 0.89 FFAR1 (0.51) FFAR1MEN1KMT2ATTRPPOX
SCHEMBL10615272 0.88 FFAR1 (0.58) FFAR1MEN1KMT2ATTRPPOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140208463-A1 ACTIVE COMPOUND COMBINATIONS COMPRISING SPECIFIC TETRAMIC ACID DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-07-24 US claimed
WO-2013020985-A1 ACTIVE COMPOUND COMBINATIONS COMPRISING SPECIFIC TETRAMIC ACID DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-02-14 WO claimed
EP-0179015-B1 7-(ARYLOXY)-2-NAPHTHOXYALKANECARBOXYLIC ACID DERIVATIVES, PROCESSES FOR THE PREPARATION OF THESE COMPOUNDS, AS WELL AS AGENTS HAVING HERBICIDAL ACTIVITY CONTAINING THESE COMPOUNDS SCHERING AKTIENGESELLSCHAFT (DE) 1988-04-13 EP claimed
US-4709077-A 7-(aryloxy)-2-naphthoxyalkanecarboxylic acid derivatives, processes for the preparation of these compounds, as well as agents having herbicidal activity containing these compounds SCHERING AKTIENGESELLSCHAFT (DE) 1987-11-24 US claimed
EP-0179015-A1 7-(Aryloxy)-2-naphthoxyalkanecarboxylic acid derivatives, processes for the preparation of these compounds, as well as agents having herbicidal activity containing these compounds SCHERING AKTIENGESELLSCHAFT (DE) 1986-04-23 EP claimed
US-11700852-B2 Aqueous electrolyte-containing adjuvant compositions, active ingredient-containing compositions and the use thereof CLARIANT INTERNATIONAL LTD (CH) 2023-07-18 US disclosed
US-20220411370-A1 Solvates Of Abscisic Acid And Liquid Compositions Containing Abscisic Acid CLARIANT INTERNATIONAL LTD. (CH) 2022-12-29 US disclosed
US-20220183282-A1 Fatty Acid Derivatives For Improving The Effect Of Agrochemical Actives CLARIANT INTERNATIONAL LTD. (CH) 2022-06-16 US disclosed
US-11304418-B2 Substituted n-(-1,3,4-oxadiazole-2-yl)aryl carboxamides and the use thereof as herbicides BAYER CROPSCIENCE AKTIENGESELLSCHAFT 2022-04-19 US disclosed
EP-3930467-A1 FATTY ACID DERIVATIVES FOR IMPROVING THE EFFECT OF AGROCHEMICAL ACTIVES Clariant International Ltd (CH) 2022-01-05 EP disclosed
WO-2021099079-A9 SOLVATES OF ABSCISIC ACID AND LIQUID COMPOSITIONS CONTAINING ABSCISIC ACID CLARIANT INTERNATIONAL LTD (CH) 2021-08-12 WO disclosed
CN-107205379-B Aqueous adjuvant composition containing electrolyte, composition containing active ingredient and use thereof 科莱恩国际有限公司 2021-08-10 CN disclosed
US-20130310254-A1 Alpha, beta-unsaturated imines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-11-21 US disclosed
EP-2561759-A1 Fluoroalkyl-substituted 2-amidobenzimidazoles and their effect on plant growth Bayer Cropscience AG (DE) 2013-02-27 EP disclosed
WO-2013020985-A1 ACTIVE COMPOUND COMBINATIONS COMPRISING SPECIFIC TETRAMIC ACID DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-02-14 WO disclosed
US-20130023413-A1 HERBICIDAL COMPOSITIONS FOR TOLERANT OR RESISTANT SOYBEAN CROPS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-01-24 US disclosed
US-20120157306-A1 Substituted Fused Pyrimidinones and Dihydropyrimidinones BAYER CROPSCIENCE AG (DE) 2012-06-21 US disclosed
US-20120157314-A1 NOVEL SUBSTITUTED PICOLINIC ACIDS, SALTS AND ACID DERIVATIVES THEREOF, AND USE THEREOF AS HERBICIDES BAYER CROPSCIENCE AG (DE) 2012-06-21 US disclosed
US-20110294663-A1 Herbicidal composition for tolerant or resistant corn crops BAYER CROPSCIENCE AG (DE) 2011-12-01 US disclosed
US-5695773-A APPLYING ONTO PLANT A DILUENT AND A SOLUTION CONSISTING OF OXYNIL AND A HERBICIDE IN LIQUID STATE CFPI AGRO (FR) 1997-12-09 US 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 (10 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-20110294663-A1 Herbicidal composition for tolerant or resistant corn crops CRY1, CYP8B1, CNPY2 FFAR1 1990/4885MEN1 2859/4885KMT2A 853/4885
US-20120157314-A1 NOVEL SUBSTITUTED PICOLINIC ACIDS, SALTS AND ACID DERIVATIVES THEREOF, AND USE THEREOF AS HERBICIDES HPD, ALAD, DDT FFAR1 438/4885MEN1 4524/4885KMT2A 3445/4885
US-20130310254-A1 Alpha, beta-unsaturated imines TTPA, ECH1, GSTO1 FFAR1 1079/4885MEN1 2014/4885KMT2A 4517/4885
US-20220183282-A1 Fatty Acid Derivatives For Improving The Effect Of Agrochemical Actives ELOVL1, FFAR1, ELOVL3 FFAR1 2/4885MEN1 402/4885KMT2A 757/4885
US-11700852-B2 Aqueous electrolyte-containing adjuvant compositions, active ingredient-containing compositions and the use thereof AQP1, PHOSPHO1, AQP3 FFAR1 3064/4885MEN1 1795/4885KMT2A 2250/4885
US-20120157306-A1 Substituted Fused Pyrimidinones and Dihydropyrimidinones DHPS, FDPS, DPYD FFAR1 1377/4885MEN1 3414/4885KMT2A 3719/4885
US-20140208463-A1 ACTIVE COMPOUND COMBINATIONS COMPRISING SPECIFIC TETRAMIC ACID DERIVATIVES DDT, TBCA, CA3 FFAR1 2431/4885MEN1 3621/4885KMT2A 3045/4885
US-11304418-B2 Substituted n-(-1,3,4-oxadiazole-2-yl)aryl carboxamides and the use thereof as herbicides DDT, NAT1, AADAC FFAR1 1476/4885MEN1 4181/4885KMT2A 771/4885
US-20220411370-A1 Solvates Of Abscisic Acid And Liquid Compositions Containing Abscisic Acid BROX, AQP3, AQP1 FFAR1 1300/4885MEN1 4634/4885KMT2A 2827/4885
US-20130023413-A1 HERBICIDAL COMPOSITIONS FOR TOLERANT OR RESISTANT SOYBEAN CROPS CTH, GGH, CBR3 FFAR1 1381/4885MEN1 4054/4885KMT2A 975/4885

“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.