SCHEMBL25630430

SCHEMBL25630430

CCCCOS(=O)(=O)OCCOS(=O)(=O)OCCCC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 13/20 0.61
CA2 P00918 13/20 0.61
CA9 Q16790 10/20 0.52
CA12 O43570 4/20 0.50
CA7 P43166 4/20 0.50
CA14 Q9ULX7 3/20 0.50
CA3 P07451 2/20 0.50
CA4 P22748 2/20 0.50
CA6 P23280 2/20 0.50
CA5A P35218 2/20 0.50
CA5B Q9Y2D0 2/20 0.50
TSHR P16473 3/20 0.48
RECQL P46063 2/20 0.48
GLA P06280 1/20 0.48
HPGD P15428 1/20 0.48
MAPK1 P28482 1/20 0.48
EPHX2 P34913 1/20 0.48
BLM P54132 1/20 0.48
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL19733 0.97 CA1 (0.64) CA1CA2CA9CA12CA7
SCHEMBL16108599 0.97 CA1 (0.64) CA1CA2CA9CA12CA7
SCHEMBL28123592 0.97 CA1 (0.64) CA1CA2CA9CA12CA7
SCHEMBL31554254 0.94 CA1 (0.61) CA1CA2CA9CA12CA7
SCHEMBL16108598 0.94 CA1 (0.61) CA1CA2CA9CA12CA7
SCHEMBL28665734 0.94 CA1 (0.61) CA1CA2CA9CA12CA7
Ammonia Solution, Strong SCHEMBL27965639 0.94 CA1 (0.61) CA1CA2CA9CA12CA7
SCHEMBL28736928 0.94 CA1 (0.61) CA1CA2CA9CA12CA7
Phosphine SCHEMBL28195308 0.94 CA1 (0.61) CA1CA2CA9CA12CA7
SCHEMBL31441238 0.92 CA1 (0.62) CA1CA2CA9CA12CA7

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
US-20230198021-A1 ELECTROLYTIC SOLUTION FOR SECONDARY BATTERY, AND SECONDARY BATTERY MURATA MANUFACTURING CO., LTD. (JP) 2023-06-22 US disclosed