Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL9698416

CCCCCCCCCCc1ccc(-c2ccc3cc(O)ccc3c2)nc1.O=S(=O)(O)C(F)(F)F

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 10/20 0.61
▸ SMN1; SMN2 Q16637 9/20 0.61
▸ NPC1 O15118 9/20 0.61
▸ MAPT P10636 3/20 0.61
▸ STAT3 P40763 1/20 0.61
▸ ATM Q13315 1/20 0.61
▸ NFKB1 P19838 4/20 0.49
▸ NFKB2 Q00653 4/20 0.49
▸ RELA Q04206 4/20 0.49
▸ CASP3 P42574 2/20 0.48
▸ SENP8 Q96LD8 2/20 0.48
▸ SENP7 Q9BQF6 2/20 0.48
▸ SENP6 Q9GZR1 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ KDM4E B2RXH2 3/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ HPGD P15428 2/20 0.45
▸ MAPK1 P28482 2/20 0.43
▸ TP53 P04637 4/20 0.40
▸ HSD17B10 Q99714 2/20 0.40

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
SCHEMBL9698530 0.89 RAB9A (0.76) RAB9ASMN1; SMN2NPC1MAPTSTAT3
Trifluoromethanesulfonic Acid SCHEMBL9698572 0.83 PTGS2 (0.50) MAPTKDM4EALDH1A1TP53HSD17B10
Trifluoromethanesulfonic Acid SCHEMBL9698643 0.83 PTGS2 (0.50) MAPTKDM4EALDH1A1TP53HSD17B10
SCHEMBL9698420 0.82 RAB9A (0.55) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL10685934 0.77 RAB9A (1.00) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL9180479 0.77 RAB9A (1.00) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL7752727 0.77 RAB9A (1.00) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL6283948 0.77 RAB9A (1.00) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL8025073 0.77 RAB9A (1.00) RAB9ASMN1; SMN2NPC1MAPTSTAT3
SCHEMBL9697509 0.76 RAB9A (0.76) RAB9ASMN1; SMN2NPC1MAPTSTAT3

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
EP-0517498-A1 Liquid crystal compounds and compositions SANYO CHEMICAL INDUSTRIES LTD. (JP) 1992-12-09 — — EP disclosed
Send feedback