SCHEMBL31558

SCHEMBL31558

NCC1CCCO1

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
SCHEMBL226122 1.00
SCHEMBL226121 1.00
Fluoride SCHEMBL10649196 1.00
Hydrochloric Acid SCHEMBL3992750 0.97
Iodide SCHEMBL3094245 0.97
Hydrochloric Acid SCHEMBL313844 0.97
Hydrochloric Acid SCHEMBL17203269 0.97
SCHEMBL458790 0.92
SCHEMBL3466034 0.92
SCHEMBL3464562 0.92

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

Appears in 6069 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115064645-B Preparation method of dispersing agent, quantum dot dispersion liquid and infrared detector 华中科技大学 2026-02-27 CN claimed
WO-2025133248-A1 DIASTEREOMERIC AMINOALCOHOL AND AMINOETHER SALTS OF 2-[(4R,S)-8-FLUORO-2-[4-(3-METHOXYPHENYL)PIPERAZIN-1-YL]-3-[2-METHOXY-5-(TRIFLUOROMETHYL)PHENYL]-3,4-DIHYDROQUINAZOLIN-4-YL]ACETIC ACID AND THEIR USE FOR ENANTIOMERIC SEPARATION AIC246 AG & CO. KG (DE) 2025-06-26 WO claimed
EP-4549616-A1 PROCESS FOR MAKING AMINES FROM CARBONYL COMPOUNDS USING HYDROGEN HAVING LOW DEUTERIUM CONTENT PRODUCED WITH NON-FOSSIL ENERGY BASF SE (DE) 2025-05-07 EP claimed
EP-4549621-A1 PROCESS FOR MAKING AMINES FROM ALCOHOLS USING HYDROGEN HAVING LOW DEUTERIUM CONTENT PRODUCED WITH NON-FOSSIL ENERGY BASF SE (DE) 2025-05-07 EP claimed
CN-115870013-B Method for continuously preparing low-reverse HMDA (high-molecular weight polyethylene) through kettle type 万华化学集团股份有限公司 2025-04-01 CN claimed
CN-119286179-A Modified cyclic polyolefin material and preparation method and application thereof 万华化学集团股份有限公司 2025-01-10 CN claimed
CN-119186628-A Catalyst for reductive amination of aldehyde ketone compounds, preparation method and application 天津大学 2024-12-27 CN claimed
US-12157717-B2 Compounds for the treatment of bovine or swine respiratory disease INTERVET INC. (US) 2024-12-03 US claimed
US-20240367098-A1 CARBON DIOXIDE ABSORBENT, METHOD FOR RECOVERING CARBON DIOXIDE, AND APPARATUS FOR SEPARATING AND RECOVERING CARBON DIOXIDE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2024-11-07 US claimed
CN-118878440-A Method for synthesizing bio-based glutaronitrile from furfural 河北工业大学 2024-11-01 CN claimed
US-4546177-A 1-(6-Hydroxy-4- or -7-methoxy-5-Benzofuranyl)-4-substituted-1,3-butanediones THE UPJOHN COMPANY (US) 1985-10-08 US claimed
US-4544749-A CATALYTIC HYDROGENATION OF FURFURYLAMINE MITSUBISHI PETROCHEMICAL COMPANY LIMITED (JP) 1985-10-01 US claimed
US-4434295-A Anti-atherosclerotic 6,7-dihydro-7,7-disubstituted-khellin analogs THE UPJOHN COMPANY (US) 1984-02-28 US claimed
US-4335045-A Preparation of N-alkenyl-2-aminomethyl-pyrrolidines SACHIM S.A. (CH) 1982-06-15 US claimed
US-4321206-A BY VAPOR PHASE EPOXIDATION OF ETHYLENE IN THE PRESENCE OF A SILVER CATALYST TEXACO DEVELOPMENT CORPORATION (US) 1982-03-23 US claimed
US-4248869-A FUNGICIDES SHIONOGI & CO., LTD. (JP) 1981-02-03 US claimed
US-4228165-A AGRICULTURAL FUNGICIDES SHIONOGI & CO., LTD. (JP) 1980-10-14 US claimed
US-4208325-A Preparation of 1-oxapenicillins and 4-acyloxy azetidinone intermediates therefor QUEEN'S UNIVERSITY AT KINGSTON (CA) 1980-06-17 US claimed
US-4129580-A Resolution of certain asymmetric primary amines using lasalocid HOFFMANN-LA ROCHE INC. (US) 1978-12-12 US claimed
US-4018782-A 1-OXAPENICILLINS, ANTIBIOTICS QUEEN'S UNIVERSITY (CA) 1977-04-19 US claimed