SCHEMBL10539461

SCHEMBL10539461

O=C1/C=C\C(=O)OC(=O)C(=O)OO1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
Maleic Anhydride SCHEMBL5638360 0.72 ALOX15 (0.39) ALDH1A1CYP2C9HPGDALOX15HSD17B10
Maleic Anhydride SCHEMBL1332547 0.71
Maleic Anhydride SCHEMBL1761076 0.71 ALDH1A1 (0.37) ALDH1A1CYP2C9HPGDALOX15HSD17B10
SCHEMBL10426127 0.71 ALDH1A1 (0.37) ALDH1A1CYP2C9HPGDALOX15HSD17B10
Maleic Anhydride SCHEMBL10482080 0.71 ALDH1A1 (0.37) ALDH1A1CYP2C9HPGDALOX15HSD17B10
Maleic Anhydride SCHEMBL191 0.71
Maleic Anhydride SCHEMBL1332543 0.71
Maleic Anhydride SCHEMBL10482026 0.71 ALDH1A1 (0.37) ALDH1A1CYP2C9HPGDALOX15HSD17B10
Maleic Anhydride SCHEMBL28234298 0.69 ALOX15 (0.38) ALDH1A1CYP2C9HPGDALOX15HSD17B10
Maleic Anhydride SCHEMBL393131 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4885355-A Water-insoluble polymers from cyclic sulfonium compounds THE DOW CHEMICAL COMPANY (US) 1989-12-05 US claimed
US-4885355-A Water-insoluble polymers from cyclic sulfonium compounds THE DOW CHEMICAL COMPANY (US) 1989-12-05 US disclosed
US-4797456-A Aqueous-dispersible cyclic sulfonium compounds that cure to form water-insoluble polymers THE DOW CHEMICAL COMPANY (US) 1989-01-10 US disclosed