SCHEMBL166380

SCHEMBL166380

COc1ccc(F)cc1OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.61
PTGS1 P23219 1/20 0.55
CA2 P00918 4/20 0.54
CA12 O43570 3/20 0.54
CA1 P00915 3/20 0.54
CA7 P43166 3/20 0.54
CA9 Q16790 3/20 0.54
CA14 Q9ULX7 3/20 0.54
ACHE P22303 1/20 0.54
CA4 P22748 2/20 0.52
CYP1A2 P05177 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C19 P33261 2/20 0.49
AHR P35869 1/20 0.49
TSHR P16473 3/20 0.46
ALDH1A1 P00352 2/20 0.46
CYP2C9 P11712 1/20 0.46
POLB P06746 1/20 0.46
MAPK1 P28482 1/20 0.46
FFAR1 O14842 1/20 0.46

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
SCHEMBL18472613 1.00 NFE2L2 (0.61) NFE2L2PTGS1CA2CA12CA1
SCHEMBL28299621 0.97 NFE2L2 (0.59) NFE2L2PTGS1CA2CA12CA1
SCHEMBL28755848 0.87 TSHR (0.52) NFE2L2PTGS1CA2CA12CA1
SCHEMBL4332893 0.86 NFE2L2 (0.48) NFE2L2PTGS1CA2CA12CA1
SCHEMBL13715600 0.86 NFE2L2 (0.48) NFE2L2PTGS1CA2CA12CA1
SCHEMBL19514870 0.85 NFE2L2 (0.49) NFE2L2PTGS1CA2CA12CA1
SCHEMBL2655152 0.84 NFE2L2 (0.47) NFE2L2PTGS1CA2CA12CA1
SCHEMBL56900 0.84 NFE2L2 (0.47) NFE2L2PTGS1CA2CA12CA1
SCHEMBL24306428 0.83 NFE2L2 (0.46) NFE2L2PTGS1ACHETSHRALDH1A1
SCHEMBL18356035 0.83 NFE2L2 (0.46) NFE2L2PTGS1CA2CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115832440-A Fluoroether organic electrolyte and sodium ion battery 深圳珈钠能源科技有限公司 2023-03-21 CN claimed
CN-111233842-B Phthalazinone diamine monomer and preparation method thereof, polyimide and preparation method thereof, and polyimide film 吉林大学 2021-01-26 CN claimed
CN-111233842-A Phthalazinone diamine monomer and preparation method thereof, polyimide and preparation method thereof, and polyimide film 吉林大学 2020-06-05 CN claimed
EP-1891180-B1 ORGANIC SEMICONDUCTOR SOLUTIONS MERCK PATENT GMBH (DE) 2018-08-29 EP claimed
EP-1716604-B1 SOLUTIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2017-07-26 EP claimed
CN-106431851-A Synthesizing method for 3,4-dimethoxy fluorobenzene as 6-fluoro-L-dopa drug intermediate 厦门莱恩斯特信息科技有限公司 2017-02-22 CN claimed
US-20160329510-A1 PHOTOVOLTAIC CELLS MERCK PATENT GMBH (DE) 2016-11-10 US claimed
EP-3087156-A1 PHOTOVOLTAIC CELLS Merck Patent GmbH (DE) 2016-11-02 EP claimed
CN-105503549-A Synthetic method of 3,4-dimethoxy fluorobenzene as6-fluoro-L-dopa intermediate CHENGDU ZHONGHENG HUATIE TECH CO LTD 2016-04-20 CN claimed
EP-1745520-B1 SOLUTIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2015-10-21 EP claimed
CN-1950959-A Solutions of organic semiconductors MERCK PATENT GMBH (DE) 2007-04-18 CN claimed
CN-1922744-A Solutions of organic semiconductors MERCK PATENT GMBH (DE) 2007-02-28 CN claimed
US-20060247291-A1 Amino acid derivatives PFIZER, INC. 2006-11-02 US claimed
WO-2006114707-A1 AMINO ACID DERIVATIVES PFIZER LIMITED (GB) 2006-11-02 WO claimed
EP-1370619-B1 SOLUTIONS AND DISPERSIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2006-06-21 EP claimed
US-20060127592-A1 Solutions and dispersions of organic semiconductors COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2006-06-15 US claimed
US-6994893-B2 Dispersions of organic semiconductors in a solvent mixture of at least two different organic solvents, characterized in that each of the solvents on its own has a boiling point of below 200 degrees C. and a melting point of 15 degrees C. or less COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2006-02-07 US claimed
US-20040225056-A1 Solutions and dispersions of organic semiconductors MERCK PATENT GMBH (DE) 2004-11-11 US claimed
CN-1143843-C Process for preparing trifluoromethyl sulfoacid 2-trimethylammonium-4,5-dimethoxy-benzaldehyde 中国科学院上海原子核研究所 2004-03-31 CN claimed
CN-1345720-A Process for preparing trifluoromethyl sulfoacid 2-trimethylammonium-4,5-dimethoxy-benzaldehyde SHANGHAI INST OF ATOMIC NUCLEU (CN) 2002-04-24 CN 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 (1 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-20060247291-A1 Amino acid derivatives OPRL1, BCAT2, BCAT1 NFE2L2 805/4885PTGS1 196/4885CA2 507/4885

“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.