SCHEMBL27267348

SCHEMBL27267348

O=S(=O)(F)CCn1cccn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.39
FDPS P14324 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
TP53 P04637 1/20 0.34
LMNA P02545 2/20 0.34
POLB P06746 1/20 0.34
THRB P10828 2/20 0.33
TSHR P16473 1/20 0.33
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HTT P42858 1/20 0.32
KDM5A P29375 1/20 0.31
KDM2B Q8NHM5 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
KDM5B Q9UGL1 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL12105119 0.80 DAO (0.39) DAOFDPSCA12CA1CA2
SCHEMBL24671995 0.80 TP53 (0.43) DAOFDPSCA12CA1CA2
SCHEMBL12744440 0.76 LMNA (0.36) DAOFDPSCA12CA1CA2
SCHEMBL5713341 0.75 DAO (0.50) DAOFDPSCA12CA1CA2
SCHEMBL22792247 0.73 BRD4 (0.38) DAOFDPSCA12CA1CA2
SCHEMBL12181347 0.72
SCHEMBL2845257 0.72
SCHEMBL7100687 0.71 DAO (0.43) DAOFDPSTHRBTSHRHDAC1
SCHEMBL3081723 0.70 FDPS (0.42) DAOFDPSLMNAPOLBTHRB
Hydrochloric Acid SCHEMBL3510080 0.70 DAO (0.40) DAOFDPSLMNATHRBTSHR

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-20240213475-A1 ADDITIVE FOR ELECTROLYTE, ELECTROLYTE FOR RECHARGEABLE LITHIUM BATTERY, AND RECHARGEABLE LITHIUM BATTERY INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2024-06-27 US disclosed