SCHEMBL728797

SCHEMBL728797

CC(=O)C1CO1

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
SCHEMBL8258119 1.00
SCHEMBL4591609 1.00 ALDH1A1 (0.33)
SCHEMBL12196225 1.00
SCHEMBL19658189 0.97 THRA (0.32)
SCHEMBL10659774 0.81
SCHEMBL17681982 0.79
SCHEMBL21957841 0.79
SCHEMBL10907748 0.79
SCHEMBL15172351 0.75 CHRM2 (0.40)
SCHEMBL17928477 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4735442-A1 IMIDAZO[1,2-alpha]PYRIDINE COMPOUNDS FOR USE IN TREATING CANCER AND INFLAMMATORY DISEASES AND METHODS TO PREPARE SAID COMPOUNDS Theranib Inc. (CA) 2026-05-06 EP claimed
US-20250011322-A1 MEDICAL COMPOUND FOR THE INHIBITION OF ALDEHYDE DEHYDROGENASE SUBTYPE 1A THERANIB INC. (CA) 2025-01-09 US claimed
CN-117659300-A Quick-dispersion polycarboxylate superplasticizer and preparation method thereof 科之杰新材料集团有限公司 2024-03-08 CN claimed
CN-117659382-A Acetyl-terminated polyether macromonomer and preparation method thereof, and concrete water reducer and preparation method thereof 科之杰新材料集团有限公司 2024-03-08 CN claimed
CN-117263863-A Arylamine alkyl substituted imidazoles compound and its synthesis method and use 吉首大学 2023-12-22 CN claimed
CN-107417535-B A kind of one-pot synthesis method of highly selective (E)-beta-nitrostyrene derivative 沅江华龙催化科技有限公司 2019-04-09 CN claimed
EP-4735442-A1 IMIDAZO[1,2-alpha]PYRIDINE COMPOUNDS FOR USE IN TREATING CANCER AND INFLAMMATORY DISEASES AND METHODS TO PREPARE SAID COMPOUNDS Theranib Inc. (CA) 2026-05-06 EP disclosed
US-20250011322-A1 MEDICAL COMPOUND FOR THE INHIBITION OF ALDEHYDE DEHYDROGENASE SUBTYPE 1A THERANIB INC. (CA) 2025-01-09 US disclosed
CN-117659300-A Quick-dispersion polycarboxylate superplasticizer and preparation method thereof 科之杰新材料集团有限公司 2024-03-08 CN disclosed
CN-117659382-A Acetyl-terminated polyether macromonomer and preparation method thereof, and concrete water reducer and preparation method thereof 科之杰新材料集团有限公司 2024-03-08 CN disclosed
CN-117263863-A Arylamine alkyl substituted imidazoles compound and its synthesis method and use 吉首大学 2023-12-22 CN disclosed
US-20230271938-A1 BENZIMIDAZOLES FOR USE IN THE TREATMENT OF CANCER AND INFLAMMATORY DISEASES CAPELLA THERAPEUTICS, INC. 2023-08-31 US disclosed
US-20230242548-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-08-03 US disclosed
US-6262278-B1 REACTING WATER AND MIXTURE OF STEREOISOMERS OF CHIRAL CYCLIC SUBSTRATE IN THE PRESENCE OF NON-RACEMIC CHIRAL CATALYST TO PRODUCE BY KINETIC RESOLUTION STEREOISOMERICALLY ENRICHED CYCLIC SUBSTRATE OR STEREOISOMERICALLY ENRICHED HYDROLYZATE PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2001-07-17 US disclosed
EP-1104395-A1 STEREOSELECTIVE RING OPENING REACTIONS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2001-06-06 EP disclosed
WO-2000009463-A1 STEREOSELECTIVE RING OPENING REACTIONS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2000-02-24 WO disclosed
CN-1163623-A Graft-modified ethylene-vinyl acetate copolymer and resin composition thereof KANEGAFUCHI CHEMICAL IND (JP) 1997-10-29 CN disclosed
US-4006169-A 1,1,1-TRICHLORO-3,4-EPOXY-2-BUTANONE OR 1,1,1-TRICHLORO-2,2-DIHYDROXY-3,4-EPOXYBUTANE SMITHKLINE CORPORATION (US) 1977-02-01 US disclosed
US-4006169-A 1,1,1-TRICHLORO-3,4-EPOXY-2-BUTANONE OR 1,1,1-TRICHLORO-2,2-DIHYDROXY-3,4-EPOXYBUTANE SMITHKLINE CORPORATION (US) 1977-02-01 US disclosed
US-3957745-A FLAVORING AND FRAGRANCE COMPOSITIONS UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-05-18 US disclosed