SCHEMBL29020554

SCHEMBL29020554

CCCC[n+]1cccc(C)c1.O=S(=O)([O-])S(=O)(=O)C(F)(F)F

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
APAF1 O14727 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
RAD52 P43351 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
Trifluoromethanesulfonic Acid SCHEMBL295685 0.91 KCNH2 (0.50) KCNH2LMNAKDM4EAPAF1ALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL29396207 0.91 KCNH2 (0.50) KCNH2LMNAKDM4EAPAF1ALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL16319907 0.88 HTT (0.44) LMNAKDM4EAPAF1ALDH1A1POLB
Trifluoromethanesulfonic Acid SCHEMBL23004549 0.86 KCNH2 (0.52) KCNH2LMNARAD52HTTSMN1; SMN2
Trifluoromethanesulfonic Acid SCHEMBL30212901 0.86 KCNH2 (0.52) KCNH2LMNARAD52HTTSMN1; SMN2
Trifluoromethanesulfonic Acid SCHEMBL23004387 0.86 KCNH2 (0.52) KCNH2LMNARAD52HTTSMN1; SMN2
Trifluoromethanesulfonic Acid SCHEMBL30329835 0.86 KCNH2 (0.52) KCNH2LMNARAD52HTTSMN1; SMN2
Trifluoromethanesulfonic Acid SCHEMBL23004140 0.86 KCNH2 (0.52) KCNH2LMNARAD52HTTSMN1; SMN2
Trifluoromethanesulfonic Acid SCHEMBL23004225 0.86 KCNH2 (0.52) KCNH2LMNARAD52HTTSMN1; SMN2
Trifluoromethanesulfonic Acid SCHEMBL30212841 0.86 KCNH2 (0.52) KCNH2LMNARAD52HTTSMN1; SMN2

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-115097551-A Optical member with surface protective film 日东电工株式会社 2022-09-23 CN disclosed