Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3883845

O=C(O)C(F)(F)F.O=C1C(Cc2c(Cl)cc(-c3c(F)cc(OCCn4ccnc4)cc3F)cc2Cl)CCN1C1CCCCC1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 11/20 0.39
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NOS1 P29475 1/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
POLB P06746 1/20 0.34
HSD11B1 P28845 1/20 0.34
CACNA1B Q00975 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
SCHEMBL3554506 0.94 TBXAS1 (0.37) TBXAS1LMNASMN1; SMN2NOS1KDM4E
Trifluoroacetic Acid SCHEMBL3882065 0.92 TBXAS1 (0.43) TBXAS1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL3544989 0.85 TBXAS1 (0.42) TBXAS1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL3544045 0.80 HSD11B1 (0.40) KDM4EPOLBHSD11B1
SCHEMBL4514496 0.80 CYP19A1 (0.42) TBXAS1NOS1KDM4EALDH1A1HSD11B1
Hydrochloric Acid SCHEMBL3880799 0.80 HSD11B1 (0.40) KDM4EPOLBHSD11B1
Trifluoroacetic Acid SCHEMBL3891031 0.79 KDM4E (0.44) MEN1KMT2AKDM4EPOLBHSD11B1
Trifluoroacetic Acid SCHEMBL3882860 0.76 HRH3 (0.43) SMN1; SMN2MEN1KMT2AKDM4EALDH1A1
SCHEMBL5507060 0.76 HSD11B1 (0.37) ALDH1A1HSD11B1
SCHEMBL3000852 0.75 HSD11B1 (0.45) MEN1KMT2AALDH1A1POLBHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1807072-B1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2009-01-07 EP claimed
US-20080275043-A1 Cycloalkyl Lactam Derivatives as Inhibitors of 11-Beta-Hydroxysteroid Dehydrogenase 1 ELI LILLY AND COMPANY 2008-11-06 US claimed
EP-1807072-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-07-18 EP claimed
WO-2006049952-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2006-05-11 WO claimed
EP-1807072-B1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2009-01-07 EP 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-20080275043-A1 Cycloalkyl Lactam Derivatives as Inhibitors of 11-Beta-Hydroxysteroid Dehydrogenase 1 HSD11B1, HSDL2, HSD17B1 TBXAS1 723/4885LMNA 1510/4885SMN1; SMN2 4576/4885

“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.