SCHEMBL96225

SCHEMBL96225

Cc1cccc([C]=O)c1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL5223374 0.82 ALDH1A1 (0.53)
SCHEMBL28886 0.81 APP (0.35)
SCHEMBL4562089 0.79 GRM5 (0.69)
SCHEMBL30469481 0.79 GRM5 (0.69)
SCHEMBL30469478 0.79 GRM5 (0.69)
Benzoyl Peroxide SCHEMBL864570 0.79 F2 (0.53)
Hydrochloric Acid SCHEMBL9124177 0.78 CYP3A4 (0.33)
SCHEMBL2321571 0.76 PTPN5 (0.42)
SCHEMBL3974204 0.76 KCNH2 (0.46)
SCHEMBL138849 0.76 GRM5 (0.50)

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 1158 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118159542-A Substituted 2, 3-dihydro [1,3] thiazolo [4,5-b ] pyridines, salts thereof and their use as herbicidal agents 拜耳公司 2024-06-07 CN claimed
US-20240033318-A1 PEPTIDYL INHIBITORS OF CALCINEURIN-NFAT INTERACTION OHIO STATE INNOVATION FOUNDATION 2024-02-01 US claimed
CN-113651863-B Unsaturated thioglycoside compound and selective synthesis method and application thereof 华东师范大学 2023-11-10 CN claimed
US-11576946-B2 Peptidyl inhibitors of calcineurin-NFAT interaction OHIO STATE INNOVATION FOUNDATION (US) 2023-02-14 US claimed
CN-114716587-A Olefin polymerization solid catalyst component containing phenylacetate compounds, and preparation method and application thereof 中国科学院化学研究所 2022-07-08 CN claimed
CN-112028813-B 4-chloro indole compound and preparation method thereof 平顶山学院 2022-03-22 CN claimed
CN-113698312-A Synthetic method of aromatic amide alkene compound 南京先进生物材料与过程装备研究院有限公司 2021-11-26 CN claimed
CN-113651863-A Unsaturated thioglycoside compound and selective synthesis method and application thereof 华东师范大学 2021-11-16 CN claimed
US-20210169966-A1 PEPTIDYL INHIBITORS OF CALCINEURIN-NFAT INTERACTION OHIO STATE INNOVATION FOUNDATION 2021-06-10 US claimed
EP-3749365-A2 PEPTIDYL INHIBITORS OF CALCINEURIN-NFAT INTERACTION Ohio State Innovation Foundation (US) 2020-12-16 EP claimed
WO-1993009117-A1 IMMUNOSTIMULATING SWAINSONINE ANALOGS TORONTO RESEARCH CHEMICALS INC. (CA) 1993-05-13 WO claimed
EP-0463162-A1 PREPARATION OF 5,6,7-TRINOR-4,8-INTER-m-PHENYLENE PGI 2 DERIVATIVES TORAY INDUSTRIES, INC. (JP) 1992-01-02 EP claimed
EP-0302787-B1 2-Methyl(4-piperidinyl)-benzofuro[2,3-c] pyridines, their preparation and therapeutical use SYNTHELABO (FR) 1991-10-30 EP claimed
US-5049551-A Antitumor UBE INDUSTRIES, LTD. (JP) 1991-09-17 US claimed
EP-0400610-A1 5-Fluorouracil derivatives UBE INDUSTRIES, LTD. (JP) 1990-12-05 EP claimed
US-4931449-A 2-((4-piperidyl)methyl)benzofuro(2,3-C)pyridine derivatives, and their application in therapy SYNTHELABO (FR) 1990-06-05 US claimed
EP-0343747-A2 Benzoyl and ketone peroxide compositions KAYAKU NOURY CORPORATION (JP) 1989-11-29 EP claimed
US-4483861-A Antihypertensive sulfur-containing compounds SANTEN PHARMACEUTICAL CO., LTD. (JP) 1984-11-20 US claimed
US-4358596-A Process for the preparation of 1,2,3-thiadiazol-5-yl ureas SCHERING AG (DE) 1982-11-09 US claimed
US-4301167-A ANTIINFLAMMATORY AGENTS, ANALGESICS INSTITUT MERIEUX (FR) 1981-11-17 US claimed