Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3757010

CN(C)C1(C(N)=O)CCCCC1.O=C(O)C(F)(F)F

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 6/20 0.34
DPP4 P27487 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
LMNA P02545 1/20 0.30
F2 P00734 1/20 0.30
F11 P03951 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 1/20 0.30

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
Trifluoroacetic Acid SCHEMBL3752131 0.98 CPB2 (0.32) CPB2F2F11PRSS1PRSS2
Trifluoroacetic Acid SCHEMBL30409503 0.95 F2 (0.31) F2F11PRSS1PRSS2PRSS3
SCHEMBL2875860 0.87 LMNA (0.36) LMNA
Hydrochloric Acid SCHEMBL19926061 0.85 LMNA (0.35) LMNA
SCHEMBL2832684 0.84 LMNA (0.33) LMNA
SCHEMBL1050696 0.80 PKM (0.31) LMNA
SCHEMBL2843811 0.76
Trifluoroacetic Acid SCHEMBL4520282 0.75 CPB2 (0.38) CPB2LMNA
Trifluoroacetic Acid SCHEMBL3757015 0.74 LMNA (0.41) CPB2LMNA
Trifluoroacetic Acid SCHEMBL4529651 0.72 CPB2 (0.36) CPB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7838518-B2 1-arylsulfonyl-3-substituted indole and indoline derivatives useful in the treatment of central nervous system disorders N.V. ORGANON (NL) 2010-11-23 US disclosed
EP-1476151-B1 1-ARYLSULFONYL-3-SUBSTITUED INDOLE AND INDOLINE DERIVATES USEFUL IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS ORGANON NV (NL) 2008-07-16 EP disclosed
US-20050154023-A1 1-arylsulfonyl-3-substituted indole and indoline derivatives useful in the treatment of central nervous system disorders MERCK SHARP & DOHME B.V. (NL) 2005-07-14 US 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-20050154023-A1 1-arylsulfonyl-3-substituted indole and indoline derivatives useful in the treatment of central nervous system disorders TPH1, HTR1A, HTR1D CPB2 4733/4885DPP4 2972/4885DPP7 3003/4885

“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.