SCHEMBL28940928

SCHEMBL28940928

O=C(O)NS(=O)(=O)O.[NaH].[NaH]

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 3/20 0.39
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA5A P35218 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
CA12 O43570 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL27520848 1.00
SCHEMBL594962 0.97
SCHEMBL10357924 0.77 NPSR1 (0.32) ACP1
SCHEMBL8781426 0.73 ACP1 (0.31) ACP1CA1CA2
SCHEMBL7113991 0.71 KDM5B (0.42) ACP1CA1CA2
SCHEMBL8314915 0.69
SCHEMBL27816457 0.69 CA1 (0.46) ACP1CA1CA2CA5ACA5B
SCHEMBL695182 0.67
SCHEMBL2014407 0.67
SCHEMBL177789 0.67

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
CN-115466202-A Dianion type surfactant and preparation method and application thereof 山东大学 2022-12-13 CN disclosed