SCHEMBL810922

SCHEMBL810922

CCC(=O)Oc1cccc(CC(C)C)c1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 10/20 0.55
ALOX15 P16050 1/20 0.51
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
TAAR1 Q96RJ0 2/20 0.45
ESR1 P03372 2/20 0.44
HIF1A Q16665 2/20 0.44
ELANE P08246 1/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL27864671 0.89 TAAR1 (0.59) ACHEALOX15MAOAMAOBTAAR1
SCHEMBL28554715 0.88 ALOX15 (0.54) ACHEALOX15MAOAMAOBTAAR1
SCHEMBL1787452 0.84 CYP3A4 (0.54) ACHEMAOAMAOBTAAR1KMT2A
SCHEMBL26153362 0.83 ACHE (0.61) ACHEESR1HIF1AELANEKMT2A
SCHEMBL6670104 0.82 ACHE (0.59) ACHEESR1HIF1AELANEKMT2A
SCHEMBL10782553 0.81 ACHE (0.71) ACHEESR1HIF1AELANEKMT2A
SCHEMBL28593564 0.81 ACHE (0.58) ACHEESR1HIF1AELANEKMT2A
SCHEMBL29542913 0.81 ACHE (0.58) ACHEESR1HIF1AELANEKMT2A
SCHEMBL27543028 0.81 ACHE (0.58) ACHEMAOBESR1HIF1AELANE
SCHEMBL5258931 0.81 ACHE (0.58) ACHEESR1HIF1AELANEKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4134362-B1 IBUPROFEN ESTER DERIVATIVE AND EMULSION FORMULATION THEREOF NANJING HERON PHARMACEUTICAL SCIENCE AND TECH CO LTD (CN) 2024-02-28 EP claimed
US-20230126556-A1 IBUPROFEN ESTER DERIVATIVE AND EMULSION PREPARATION THEREOF NANJING HERON PHARMACEUTICAL SCIENCE AND TECHNOLOGY CO., LTD. (CN) 2023-04-27 US claimed
EP-4134362-A1 IBUPROFEN ESTER DERIVATIVE AND EMULSION FORMULATION THEREOF Nanjing Heron Pharmaceutical Science and Technology Co., Ltd. (CN) 2023-02-15 EP claimed
CN-114728883-A Ibuprofen ester prodrug, pharmaceutical composition, preparation method and application 南京海融医药科技股份有限公司 2022-07-08 CN claimed
CN-114728882-A Ibuprofen ester derivative and emulsion preparation thereof 南京海融医药科技股份有限公司 2022-07-08 CN claimed
CN-114380785-A Ibuprofen derivative, preparation method and application 南京海融医药科技股份有限公司 2022-04-22 CN claimed
US-9089549-B2 Compositions and methods for preventing cardiac arrhythmia CORMATRIX CARDIOVASCULAR, INC. (US) 2015-07-28 US claimed
US-20150150914-A1 Compositions and Methods for Preventing Cardiac Arrhythmia CORVIVO CARDIOVASCULAR, INC. 2015-06-04 US claimed
CN-104529959-A Synthesis method of ramelteon JIANGSU JIAYI PHARMACEUTICAL CO LTD 2015-04-22 CN claimed
US-20070020245-A1 Composition for the treatment of arthrosis/arthritis, especially for treating joints TROTT KATHARINA 2007-01-25 US claimed
JP-9002949-A None JP disclosed
US-20250177307-A1 IMPROVED MANUFACTURING PROCESS HALEON (SUZHOU) PHARMACEUTICAL CO., LTD. (CN) 2025-06-05 US disclosed
CN-114728883-B Ibuprofen ester prodrug, pharmaceutical composition, preparation method and application 南京海融医药科技股份有限公司 2024-07-12 CN disclosed
CN-117355527-B Anti-inflammatory coupling compound medicine and preparation method and application thereof 上海椿安生物医药科技有限公司 2024-06-07 CN disclosed
CN-118020932-A Application of Meinaria fruit leaf extract in reducing arecoline toxicity 华南农业大学 2024-05-14 CN disclosed
US-5266723-A Process for the preparation of optically active 2-aryl-alkanoic acids, especially 2-aryl-propionic acids MEDICE, LTD., CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) 1993-11-30 US disclosed
US-5248815-A STEREO-SELECTIVE SYNTHESIS OF 2-ARYL-PROPIONIC ACIDS OF HIGH OPTICAL PURITY BY USING CHIRAL OXAZOLINES PARADIES HENRICH H (DE) 1993-09-28 US disclosed
WO-1993013046-A1 STEREO-SELECTIVE SYNTHESIS OF 2-ARYL-PROPIONIC ACIDS OF HIGH OPTICAL PURITY BY USING CHIRAL OXAZOLINES KUNICHEM, INC. (US) 1993-07-08 WO disclosed
EP-0110671-B1 PREPARATION OF OPTICALLY ACTIVE ALPHA-ARYLALKANOIC ACIDS AND PRECURSORS THEREOF SYNTEX PHARMACEUTICALS INTERNATIONAL LIMITED (BM) 1986-05-21 EP disclosed
JP-H00710749-A 0001-01-01 JP 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 (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-20230126556-A1 IBUPROFEN ESTER DERIVATIVE AND EMULSION PREPARATION THEREOF CYP2C9, CYP2C19, CYP4B1 ACHE 648/4885ALOX15 98/4885MAOA 2460/4885

“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.