Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL1111035

C[N+](C)(C)c1ccc(C(=O)Nc2c3c(nc4ccccc24)N(Cc2ccccc2)CC3)cc1C(F)(F)F.O=S(=O)(O)C(F)(F)F

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.51
ALDH1A1 P00352 7/20 0.51
GAA P10253 6/20 0.51
KMT2A Q03164 4/20 0.51
HPGD P15428 4/20 0.51
MEN1 O00255 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HSD17B10 Q99714 2/20 0.47
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
GLA P06280 3/20 0.38
RCE1 Q9Y256 1/20 0.38
POLB P06746 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
ADORA2A P29274 1/20 0.35
MGLL Q99685 1/20 0.35
AURKA O14965 1/20 0.35
BCHE P06276 1/20 0.34
CTNNB1 P35222 1/20 0.34

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
SCHEMBL6783336 0.84 KDM4E (0.56) KDM4EALDH1A1GAAKMT2AHPGD
SCHEMBL6790901 0.76 KDM4E (0.56) KDM4EALDH1A1GAAKMT2AHPGD
SCHEMBL6783637 0.73 KDM4E (0.70) KDM4EALDH1A1GAAKMT2AHPGD
SCHEMBL6785609 0.71 ALDH1A1 (0.61) KDM4EALDH1A1GAAKMT2AHPGD
SCHEMBL29642712 0.70 KDM4E (0.74) KDM4EALDH1A1GAAKMT2AHPGD
SCHEMBL6783544 0.70 KDM4E (0.74) KDM4EALDH1A1GAAKMT2AHPGD
SCHEMBL6781147 0.69 KDM4E (0.94) KDM4EALDH1A1GAAKMT2AHPGD
Trifluoromethanesulfonic Acid SCHEMBL1110858 0.66 SRD5A2 (0.38) SMN1; SMN2POLB
SCHEMBL6780160 0.65 KDM4E (0.58) KDM4EALDH1A1GAAKMT2AHPGD
SCHEMBL6780670 0.64 KMT2A (0.53) KDM4EALDH1A1GAAKMT2AHPGD

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3056509-A1 BOMBESIN ANALOGUES FOR USE IN DIAGNOSIS Piramal Imaging SA (CH) 2016-08-17 EP disclosed
EP-2455105-B1 Bombesin analogues PIRAMAL IMAGING SA (CH) 2016-02-17 EP disclosed
EP-2063918-B1 COMPOUNDS AND METHODS FOR 18F LABELED AGENTS PIRAMAL IMAGING SA (CH) 2014-02-26 EP disclosed
US-8557776-B2 Compounds and methods for 18F labeled agents Bayer Pharma AG (DE) 2013-10-15 US disclosed
EP-2455105-A2 Bombesin analogues Bayer Pharma Aktiengesellschaft (DE) 2012-05-23 EP disclosed
EP-2289564-A2 Derivatives of aniline as precursors for F18-labeling Bayer Schering Pharma Aktiengesellschaft (DE) 2011-03-02 EP disclosed
EP-2279759-A2 Compounds and methods for 18F labeled agents Bayer Schering Pharma Aktiengesellschaft (DE) 2011-02-02 EP disclosed
EP-2063918-A2 COMPOUNDS AND METHODS FOR 18F LABELED AGENTS Bayer Schering Pharma AG (DE) 2009-06-03 EP disclosed
US-20080292548-A1 COMPOUNDS AND METHODS FOR 18F LABELED AGENTS Lantheus Biosciences Ltd. (GB) 2008-11-27 US disclosed
WO-2008028688-A2 COMPOUNDS AND METHODS FOR 18F LABELED AGENTS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-03-13 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080292548-A1 COMPOUNDS AND METHODS FOR 18F LABELED AGENTS QPCT, GBA2, GBA1 KDM4E 2022/4885ALDH1A1 2019/4885GAA 37/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.