SCHEMBL999345

SCHEMBL999345

CC(C)(C)OC(=O)Nc1cccc(CC(=O)O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 2/20 0.60
ENPP2 Q13822 2/20 0.55
SELP P16109 2/20 0.52
SELE P16581 2/20 0.52
HPSE Q9Y251 1/20 0.52
PPARD Q03181 2/20 0.50
PPARG P37231 1/20 0.50
PPARA Q07869 1/20 0.50
SELL P14151 1/20 0.49
GLS O94925 1/20 0.48
AURKA O14965 1/20 0.48
RPS6KB1 P23443 1/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.47
SIRT2 Q8IXJ6 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
HDAC3 O15379 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC8 Q9BY41 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
SCHEMBL21583942 0.89 AURKA (0.48) NR1H4ENPP2GLSAURKARPS6KB1
SCHEMBL30489985 0.87 AURKA (0.47) NR1H4ENPP2PPARGGLSAURKA
SCHEMBL14987466 0.87 AURKA (0.53) NR1H4ENPP2GLSAURKARPS6KB1
SCHEMBL23592977 0.87 AURKA (0.47) NR1H4ENPP2PPARGGLSAURKA
SCHEMBL31710176 0.86 GLS (0.49) NR1H4SELPSELEGLSAURKA
SCHEMBL306849 0.86 ITGB3 (0.52) NR1H4PPARDPPARGPPARAAURKA
SCHEMBL7156537 0.86 MGLL (0.52) GLSAURKARPS6KB1SIRT2CYP2C19
SCHEMBL31139332 0.85 PDK1 (0.58) GLSAURKARPS6KB1SIRT2CYP2C19
SCHEMBL1985668 0.85 MAPT (0.54) AURKARPS6KB1SIRT2CYP2C19HDAC3
SCHEMBL8711740 0.85 AURKA (0.50) GLSAURKARPS6KB1SIRT2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250325542-A1 INHIBITORS OF ANTIMOCROBIAL RESISTANCE AND METHOS USING SAME BAYLOR COLLEGE MEDICINE (US) 2025-10-23 US disclosed
WO-2025048759-A1 BENZIMIDAZOLE DERIVATIVES AS MPGES-1 INHIBITORS ICOSYN THERAPEUTICS SAGLIK TEKNOLOJILERI ANONIM SIRKETI (TR) 2025-03-06 WO disclosed
US-20240174685-A1 OX2R Compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-05-30 US disclosed
US-11905297-B2 OX2R compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-02-20 US disclosed
US-20230219961-A1 Pyridine acetamide derivative serving as CDK inhibitor, and preparation method therefor and use thereof Suzhou Alphama Biotechnology Co., Ltd. (CN) 2023-07-13 US disclosed
US-20230219961-A1 Pyridine acetamide derivative serving as CDK inhibitor, and preparation method therefor and use thereof Suzhou Alphama Biotechnology Co., Ltd. (CN) 2023-07-13 US disclosed
US-20230122024-A1 OX2R Compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-04-20 US disclosed
CN-115340555-A Pyridine acetamide derivative as CDK inhibitor, and preparation method and application thereof 苏州阿尔脉生物科技有限公司 2022-11-15 CN disclosed
US-11479560-B2 OX2R compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2022-10-25 US disclosed
US-11472813-B2 OX2R compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-10-18 US disclosed
US-20050187277-A1 Substituted azole derivatives, compositions, and methods of use TRANSTECH PHARMA, INC. 2005-08-25 US disclosed
US-20050153876-A1 Compositions of lipopeptide antibiotic derivatives and methods of use thereof MIGENIX INC. (CA) 2005-07-14 US disclosed
WO-2005000878-A2 COMPOSITIONS OF LIPOPEPTIDE ANTIBIOTIC DERIVATIVES AND METHODS OF USE THEREOF MIGENIX INC. (CA) 2005-01-06 WO disclosed
US-6835724-B2 Topical antiinflammatory agents for treating inflammatory dermatoses AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-12-28 US disclosed
US-20020103392-A1 CORTICOID-17,21-DICARBOXYLIC ESTERS AND CORTICOSTEROID 17-CARBOXYLIC ESTER 21-CARBONIC ESTERS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICALS CONTAINING THESE COMPOUNDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-08-01 US disclosed
US-5824670-A ANTIINFLAMMATORY AGENTS; TREATING DERMATOSES HOECHST AKTIENGESELLSCHAFT (DE) 1998-10-20 US disclosed
US-5608093-A ANTIINFLAMMATORY AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed
EP-0288737-A1 Rapid hybridization assay using latex-immobilized probe MILES INC. (US) 1988-11-02 EP disclosed
US-4308269-A ANTITUMOUR AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-12-29 US disclosed
EP-0021173-A1 Maytansinoids, their production and use Takeda Chemical Industries, Ltd. (JP) 1981-01-07 EP 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-11479560-B2 OX2R compounds HCRTR2, HCRTR1, OXTR NR1H4 262/4885ENPP2 1506/4885SELP 4409/4885
US-11905297-B2 OX2R compounds HCRTR2, HCRTR1, OXTR NR1H4 262/4885ENPP2 1506/4885SELP 4409/4885
US-20250325542-A1 INHIBITORS OF ANTIMOCROBIAL RESISTANCE AND METHOS USING SAME BPGM, PNMT, DDT NR1H4 3173/4885ENPP2 4499/4885SELP 1975/4885
US-20240174685-A1 OX2R Compounds HCRTR2, HCRTR1, OXTR NR1H4 262/4885ENPP2 1506/4885SELP 4409/4885
US-20020103392-A1 CORTICOID-17,21-DICARBOXYLIC ESTERS AND CORTICOSTEROID 17-CARBOXYLIC ESTER 21-CARBONIC ESTERS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICALS CONTAINING THESE COMPOUNDS NR3C1, HSD3B1, HSD17B7 NR1H4 97/4885ENPP2 2587/4885SELP 4660/4885
US-20050153876-A1 Compositions of lipopeptide antibiotic derivatives and methods of use thereof NRDC, NOD2, NGLY1 NR1H4 2501/4885ENPP2 312/4885SELP 1981/4885
US-20050187277-A1 Substituted azole derivatives, compositions, and methods of use PTPRO, PTPN5, PTPRE NR1H4 1603/4885ENPP2 402/4885SELP 2093/4885
US-20230219961-A1 Pyridine acetamide derivative serving as CDK inhibitor, and preparation method therefor and use thereof CDK9, CDK7, CDK8 NR1H4 2917/4885ENPP2 1422/4885SELP 4763/4885
US-20230122024-A1 OX2R Compounds HCRTR2, HCRTR1, OXTR NR1H4 262/4885ENPP2 1506/4885SELP 4409/4885
US-11472813-B2 OX2R compounds HCRTR2, HCRTR1, OXTR NR1H4 262/4885ENPP2 1506/4885SELP 4409/4885

“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.