SCHEMBL361183

SCHEMBL361183

COc1cccc(C(C)C(=O)O)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 5/20 0.73
PTGS2 P35354 6/20 0.68
AKR1C3 P42330 4/20 0.68
AKR1C2 P52895 4/20 0.68
SLC22A6 Q4U2R8 2/20 0.68
CDC42 P60953 1/20 0.68
RAC1 P63000 1/20 0.68
CYP1A2 P05177 1/20 0.68
TSHR P16473 1/20 0.68
AKR1C4 P17516 1/20 0.59
AKR1C1 Q04828 1/20 0.59
MAPT P10636 2/20 0.56
CXCR1 P25024 2/20 0.56
CXCR2 P25025 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
RECQL P46063 1/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
CYP3A4 P08684 1/20 0.56

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
SCHEMBL15641441 1.00 PTGS1 (0.73) PTGS1PTGS2AKR1C3AKR1C2SLC22A6
SCHEMBL10629616 1.00 PTGS1 (0.73) PTGS1PTGS2AKR1C3AKR1C2SLC22A6
SCHEMBL31635557 1.00 PTGS1 (0.73) PTGS1PTGS2AKR1C3AKR1C2SLC22A6
Hydrochloric Acid SCHEMBL5888904 0.98 PTGS1 (0.71) PTGS1PTGS2AKR1C3AKR1C2SLC22A6
Hydrochloric Acid SCHEMBL5888906 0.98 PTGS1 (0.71) PTGS1PTGS2AKR1C3AKR1C2SLC22A6
SCHEMBL16800683 0.89 PTGS1 (0.58) PTGS1PTGS2AKR1C3AKR1C2SLC22A6
SCHEMBL27606784 0.87 PTGS1 (0.56) PTGS1PTGS2AKR1C3AKR1C2SLC22A6
SCHEMBL10443229 0.86 PTGS1 (0.55) PTGS1PTGS2AKR1C3AKR1C2SLC22A6
SCHEMBL1416702 0.86 PTGS1 (0.73) PTGS1PTGS2AKR1C3AKR1C2SLC22A6
Anisole SCHEMBL28171713 0.85 PTGS1 (0.62) PTGS1PTGS2AKR1C3AKR1C2SLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025030241-A1 COATING MATERIALS BASED ON FUNCTIONALIZED ORGANIC MOLECULES AND USES THEREOF IN ELECTROCHEMICAL APPLICATIONS HYDRO-QUéBEC (CA) 2025-02-13 WO claimed
CN-118130691-A Method for detecting characteristic components of typical aroma in main stream smoke of cigarettes 上海烟草集团有限责任公司 2024-06-04 CN claimed
EP-4348733-A1 COATING MATERIALS BASED ON UNSATURATED ALIPHATIC HYDROCARBONS AND USES THEREOF IN ELECTROCHEMICAL APPLICATIONS Hydro-Québec (CA) 2024-04-10 EP claimed
EP-4348734-A1 ELECTRODE BINDERS COMPRISING A BLEND OF A POLYBUTADIENE-BASED POLYMER AND A POLYNORBORNENE-BASED POLYMER, ELECTRODES COMPRISING SAME AND USE THEREOF IN ELECTROCHEMISTRY Hydro-Québec (CA) 2024-04-10 EP claimed
WO-2022251969-A1 ELECTRODE BINDERS COMPRISING A BLEND OF A POLYBUTADIENE-BASED POLYMER AND A POLYNORBORNENE-BASED POLYMER, ELECTRODES COMPRISING SAME AND USE THEREOF IN ELECTROCHEMISTRY HYDRO-QUéBEC (CA) 2022-12-08 WO claimed
WO-2022251968-A1 COATING MATERIALS BASED ON UNSATURATED ALIPHATIC HYDROCARBONS AND USES THEREOF IN ELECTROCHEMICAL APPLICATIONS HYDRO-QUéBEC (CA) 2022-12-08 WO claimed
CN-101735037-A Synthesis method of sweet taste inhibitor 2-(4- methoxyphenyl) sodium propionate UNIV HUAZHONG AGRICULTURAL 2010-06-16 CN claimed
WO-2026101197-A1 SIGNAL PROCESSING DEVICE AND VEHICLE CONTROL DEVICE INCLUDING SAME 엘지전자 주식회사 2026-05-15 WO disclosed
US-20250111889-A1 DE NOVO DESIGNED MACROCYCLIC OLIGOAMIDES UNIVERSITY OF WASHINGTON 2025-04-03 US disclosed
WO-2025030241-A1 COATING MATERIALS BASED ON FUNCTIONALIZED ORGANIC MOLECULES AND USES THEREOF IN ELECTROCHEMICAL APPLICATIONS HYDRO-QUéBEC (CA) 2025-02-13 WO disclosed
CN-118607955-A GIS-based explosive road transportation accident damage consequence assessment method 江汉大学 2024-09-06 CN disclosed
CN-118130691-A Method for detecting characteristic components of typical aroma in main stream smoke of cigarettes 上海烟草集团有限责任公司 2024-06-04 CN disclosed
CN-118078941-A Anti-ovarian cancer pharmaceutical composition and acting target thereof 浙江中医药大学 2024-05-28 CN disclosed
EP-0874829-A1 AMINO ACID DERIVATIVES, THE PREPARATION AND USE THEREOF AS ENDOTHELIN ANTAGONISTS BASF AKTIENGESELLSCHAFT (DE) 1998-11-04 EP disclosed
WO-1998031697-A1 ARYL C-GLYCOSIDE COMPOUNDS AND SULFATED ESTERS THEREOF SANKYO COMPANY, LIMITED (JP) 1998-07-23 WO disclosed
WO-1997012878-A1 AMINO ACID DERIVATIVES, THE PREPARATION AND USE THEREOF AS ENDOTHELIN ANTAGONISTS BASF AKTIENGESELLSCHAFT (DE) 1997-04-10 WO disclosed
EP-0386243-A1 PLATINUM (II) COMPLEXES SAGAMI CHEMICAL RESEARCH CENTER (JP) 1990-09-12 EP disclosed
US-4723033-A REACTING ALPHA METAL ACID DERIVATIVE AND ARYL HALIDE WITH OPTICALLY ACTIVE CATALYST SYNTEX PHARMACEUTICALS INTERNATIONAL LTD. (BM) 1988-02-02 US disclosed
EP-0110671-B1 PREPARATION OF OPTICALLY ACTIVE ALPHA-ARYLALKANOIC ACIDS AND PRECURSORS THEREOF SYNTEX PHARMACEUTICALS INTERNATIONAL LIMITED (BM) 1986-05-21 EP disclosed
EP-0110671-A1 Preparation of optically active alpha-arylalkanoic acids and precursors thereof SYNTEX PHARMACEUTICALS INTERNATIONAL LIMITED (BM) 1984-06-13 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 (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-20250111889-A1 DE NOVO DESIGNED MACROCYCLIC OLIGOAMIDES DHFR, CCNH, ODC1 PTGS1 2424/4885PTGS2 1813/4885AKR1C3 3307/4885

“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.