SCHEMBL31485809

SCHEMBL31485809

NS(=O)(=O)c1nnc(NC(=O)CCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)O)s1

nearest known ligand 0.89

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 20/20 0.89
▸ CA2 P00918 20/20 0.89
▸ CA9 Q16790 10/20 0.89
▸ CA4 P22748 10/20 0.89
▸ CA12 O43570 9/20 0.89
▸ CA14 Q9ULX7 9/20 0.89
▸ CA3 P07451 5/20 0.70
▸ CA6 P23280 5/20 0.70
▸ CA5A P35218 5/20 0.70
▸ CA7 P43166 5/20 0.70
▸ CA13 Q8N1Q1 5/20 0.70
▸ CA5B Q9Y2D0 5/20 0.70

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
SCHEMBL31485791 1.00 CA1 (0.89) CA1CA2CA9CA4CA12
SCHEMBL16983305 0.90 CA1 (0.91) CA1CA2CA9CA4CA12
SCHEMBL31485812 0.84 CA1 (0.76) CA1CA2CA9CA4CA12
SCHEMBL16975090 0.83 CA2 (1.00) CA1CA2CA9CA4CA12
SCHEMBL18476520 0.75 CA1 (0.78) CA1CA2CA9CA4CA12
SCHEMBL18475604 0.74 CA1 (0.76) CA1CA2CA9CA4CA12
SCHEMBL13740942 0.74 CA2 (1.00) CA1CA2CA9CA4CA12
SCHEMBL19359112 0.74 CA1 (0.83) CA1CA2CA9CA4CA12
SCHEMBL20792488 0.73 CA1 (0.72) CA1CA2CA9CA4CA12
SCHEMBL19359120 0.73 CA2 (0.77) CA1CA2CA9CA4CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025076128-A1 ADAPTORS FOR ADOPTIVE CELL THERAPY AND COMPOUNDS FOR PREPARING SAME UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2025-04-10 — — WO disclosed
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