SCHEMBL31599480

SCHEMBL31599480

CS(=O)(=O)CCCCOS(C)(=O)=O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.75
ALDH1A1 P00352 2/20 0.75
LMNA P02545 2/20 0.75
USP2 O75604 2/20 0.75
KDM4E B2RXH2 1/20 0.75
MMP9 P14780 1/20 0.75
ALOX15 P16050 1/20 0.75
CA1 P00915 16/20 0.40
CA2 P00918 16/20 0.40
CA9 Q16790 15/20 0.40
TP53 P04637 1/20 0.39
CA12 O43570 5/20 0.39
CA7 P43166 5/20 0.39
CA14 Q9ULX7 5/20 0.39
CA3 P07451 4/20 0.39
CA4 P22748 4/20 0.39
CA6 P23280 4/20 0.39
CA5A P35218 4/20 0.39
CA5B Q9Y2D0 4/20 0.39
GLA P06280 1/20 0.35

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
SCHEMBL14608856 0.98 TSHR (0.71) TSHRALDH1A1LMNAUSP2KDM4E
SCHEMBL21616872 0.98 TSHR (0.71) TSHRALDH1A1LMNAUSP2KDM4E
SCHEMBL223147 0.92 USP2 (0.70) TSHRALDH1A1LMNAUSP2KDM4E
SCHEMBL9615608 0.88 TSHR (0.71) TSHRALDH1A1LMNAUSP2KDM4E
Busulfan SCHEMBL4764696 0.87 TSHR (1.00) TSHRALDH1A1LMNAUSP2KDM4E
Busulfan SCHEMBL4373 0.87 TSHR (1.00) TSHRALDH1A1LMNAUSP2KDM4E
SCHEMBL4952202 0.84 TSHR (0.94) TSHRALDH1A1LMNAUSP2KDM4E
SCHEMBL4298840 0.84 TSHR (0.94) TSHRALDH1A1LMNAUSP2KDM4E
SCHEMBL1335477 0.84 TSHR (0.94) TSHRALDH1A1LMNAUSP2KDM4E
SCHEMBL4954793 0.84 TSHR (0.94) TSHRALDH1A1LMNAUSP2KDM4E

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-2025111296-A1 ELECTROLYTE COMPOSITIONS AND ELECTROCHEMICAL DEVICES USING THE SAME II-VI DELAWARE, INC. (US) 2025-05-30 WO disclosed