SCHEMBL9717355

SCHEMBL9717355

C=CC[S+]([O-])Br

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
SCHEMBL4801334 0.73
SCHEMBL3676210 0.72
SCHEMBL9635 0.72
Ammonia Solution, Strong SCHEMBL10454832 0.69
SCHEMBL9774990 0.67
SCHEMBL2143466 0.67
SCHEMBL3302971 0.67
SCHEMBL2106867 0.67
SCHEMBL6590038 0.65
Dimethyl Sulfoxide SCHEMBL20866176 0.65

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0289324-B1 METHOD FOR RACEMIZATION OF OPTICALLY ACTIVE CHRYSANTHEMIC ACID DERIVATIVES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-07-08 EP claimed
EP-0282221-B1 METHOD FOR RACEMIZATION OF OPTICALLY ACTIVE CHRYSANTHEMIC ACID OR ITS ESTER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-01-15 EP claimed
US-4820864-A Method for racemization of optically active chrysanthemic acid or its ester SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-04-11 US claimed
US-4812264-A Method for racemization of optically active chrysanthemic acid derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-03-14 US claimed
EP-0289324-A1 Method for racemization of optically active chrysanthemic acid derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-11-02 EP claimed
EP-0282221-A2 Method for racemization of optically active chrysanthemic acid or its ester SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-09-14 EP claimed