SCHEMBL2445501

SCHEMBL2445501

CCCCCS(=O)(=O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.61
KEAP1 Q14145 1/20 0.54
NFE2L2 Q16236 1/20 0.54
HDAC1 Q13547 3/20 0.53
HDAC2 Q92769 2/20 0.53
HDAC8 Q9BY41 2/20 0.53
HDAC3 O15379 1/20 0.53
HDAC4 P56524 1/20 0.53
HDAC7 Q8WUI4 1/20 0.53
HDAC10 Q969S8 1/20 0.53
HDAC11 Q96DB2 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
HDAC9 Q9UKV0 1/20 0.53
HDAC5 Q9UQL6 1/20 0.53
TDP1 Q9NUW8 1/20 0.52
ALDH1A1 P00352 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
THRA P10827 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
Benzene SCHEMBL6390523 1.00 PSIP1 (0.61) PSIP1KEAP1NFE2L2HDAC1HDAC2
SCHEMBL6673936 0.98 PSIP1 (0.59) PSIP1KEAP1NFE2L2HDAC1HDAC2
SCHEMBL8778748 0.98 PSIP1 (0.59) PSIP1KEAP1NFE2L2HDAC1HDAC2
SCHEMBL588204 0.98 PSIP1 (0.59) PSIP1KEAP1NFE2L2HDAC1HDAC2
SCHEMBL16087603 0.98 PSIP1 (0.59) PSIP1KEAP1NFE2L2HDAC1HDAC2
SCHEMBL10616984 0.98 PSIP1 (0.59) PSIP1KEAP1NFE2L2HDAC1HDAC2
SCHEMBL8778740 0.98 PSIP1 (0.59) PSIP1KEAP1NFE2L2HDAC1HDAC2
SCHEMBL5963682 0.98 PSIP1 (0.59) PSIP1KEAP1NFE2L2HDAC1HDAC2
SCHEMBL2446192 0.98 PSIP1 (0.59) PSIP1KEAP1NFE2L2HDAC1HDAC2
SCHEMBL27510240 0.98 PSIP1 (0.59) PSIP1KEAP1NFE2L2HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104010505-A Pesticidal compositions and methods related thereto DOW AGROSCIENCES LLC 2014-08-27 CN claimed
EP-0939630-B1 USE OF BENZOPYRANOLS TO TREAT NEUROLOGICAL DISORDERS SMITHKLINE BEECHAM PLC (GB) 2004-06-30 EP claimed
US-20030069300-A1 Use of benzopyranols to treat neurological disorders SMITHKLINE BEECHAM, PLC 2003-04-10 US claimed
US-6492415-B2 ESPECIALLY FOR TRIGEMINAL NEURALGIA AND NEUROPATHIC PAIN. SMITHKLINE BEECHAM P.L.C. (GB) 2002-12-10 US claimed
US-20020010209-A1 Use of benzopyranols to treat neurological disorders PARSONS ANDREW (GB) 2002-01-24 US claimed
EP-0764159-B1 C -4 AMIDE SUBSTITUTED COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS SMITHKLINE BEECHAM PLC (GB) 2000-08-09 EP claimed
EP-0939630-A1 USE OF BENZOPYRANOLS TO TREAT NEUROLOGICAL DISORDERS SMITHKLINE BEECHAM PLC (GB) 1999-09-08 EP claimed
WO-1998011890-A1 USE OF BENZOPYRANOLS TO TREAT NEUROLOGICAL DISORDERS SMITHKLINE BEECHAM PLC (GB) 1998-03-26 WO claimed
EP-0602914-B1 Ink compositions for ink jet printing XEROX CORP (US) 1997-11-12 EP claimed
EP-0764159-A1 C -4 AMIDE SUBSTITUTED COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS SMITHKLINE BEECHAM PLC (GB) 1997-03-26 EP claimed
WO-1995034547-A1 C-4 AMIDE SUBSTITUTED COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS SMITHKLINE BEECHAM PLC (GB) 1995-12-21 WO claimed
US-5300143-A Water soluble dye, sulfone, and amide or cyclic amine XEROX CORPORATION (US) 1994-04-05 US claimed
CN-115697058-B Agrochemical adjuvants 禾大国际股份公开有限公司 2025-05-13 CN disclosed
CN-115702132-B Composition for enhancing nitrogen stabilizer, method and use thereof 沃戴申生命科学美国有限责任公司 2025-02-21 CN disclosed
CN-115334884-B Clomazone composition for improving nitrogen nutrient use efficiency and plant growth 沃戴申生命科学美国有限责任公司 2025-01-07 CN disclosed
CN-118696031-A Aryltetrahydropyridine derivative or salt thereof, pest control agent containing the same, and method for using the same 日本农药株式会社 2024-09-24 CN disclosed
WO-1991000280-A1 6-(HYDRONAPHTYL-1-ETHYL)-4-HYDROXY-3,4,5,6-TETRAHYDRO-2H-PYRAN-2-ONES AND THE CORRESPONDING HYDROXY ACIDS BRITISH BIO-TECHNOLOGY LIMITED (GB) 1991-01-10 WO disclosed
US-4873278-A Inhibition of irradiation yellowing in polysulfone compositions GENERAL ELECTRIC COMPANY (US) 1989-10-10 US disclosed
US-4485872-A FLOW CONTROL AGENTS PHILLIPS PETROLEUM COMPANY (US) 1984-12-04 US disclosed
US-4028422-A SEX ATTRACTANTS FOR FLIES AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1977-06-07 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 (2 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-20030069300-A1 Use of benzopyranols to treat neurological disorders TARDBP, HTT, GRIN3A PSIP1 3502/4885KEAP1 3296/4885NFE2L2 1116/4885
US-20020010209-A1 Use of benzopyranols to treat neurological disorders TARDBP, HTT, GRIN3A PSIP1 3502/4885KEAP1 3296/4885NFE2L2 1116/4885

“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.