SCHEMBL30009374

SCHEMBL30009374

CCCCS(=O)(=O)O.CCCOS(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
ALDH1A1 P00352 2/20 0.48
LMNA P02545 2/20 0.48
KDM4E B2RXH2 1/20 0.48
USP2 O75604 1/20 0.48
MMP9 P14780 1/20 0.48
ALOX15 P16050 1/20 0.48
CA1 P00915 11/20 0.40
CA2 P00918 11/20 0.40
APP P05067 1/20 0.37
CA9 Q16790 8/20 0.36
EPHX2 P34913 2/20 0.36
CA12 O43570 3/20 0.35
CA7 P43166 3/20 0.35
CA14 Q9ULX7 3/20 0.35
CA3 P07451 2/20 0.35
CA4 P22748 2/20 0.35
CA6 P23280 2/20 0.35
CA5A P35218 2/20 0.35
CA5B Q9Y2D0 2/20 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
SCHEMBL19406730 0.83 USP2 (0.64) TSHRALDH1A1LMNAKDM4EUSP2
SCHEMBL27912637 0.81 TSHR (0.68) TSHRALDH1A1LMNAKDM4EUSP2
SCHEMBL565251 0.80 USP2 (0.57) TSHRALDH1A1LMNAKDM4EUSP2
SCHEMBL502063 0.80
SCHEMBL31512497 0.80
SCHEMBL10012319 0.80
SCHEMBL5015 0.80
Busulfan SCHEMBL21456804 0.79 TSHR (0.65) TSHRALDH1A1LMNAKDM4EUSP2
Alcohol SCHEMBL16767380 0.78 TSHR (0.55) TSHRALDH1A1LMNAKDM4EUSP2
Phosphine SCHEMBL2572785 0.78

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
CN-115882062-A Electrolyte for secondary battery and lithium secondary battery comprising same SK新能源株式会社 2023-03-31 CN disclosed
CN-115775919-A Lithium secondary battery SK新能源株式会社 2023-03-10 CN disclosed
CN-115224363-A Electrolyte for secondary battery and lithium secondary battery comprising same SK新技术株式会社 2022-10-21 CN disclosed