Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL23454672

C[C@H](NC(=O)O)C(=O)NCc1cc(Cl)ccc1-n1cnnn1.O=C(O)C(F)(F)F

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MASP2 O00187 2/20 0.60
F2 P00734 16/20 0.59
CYP3A4 P08684 2/20 0.48
F11 P03951 2/20 0.48
F10 P00742 2/20 0.46
F9 P00740 1/20 0.46
PLAT P00750 1/20 0.46
KLKB1 P03952 1/20 0.46
PRSS1 P07477 1/20 0.46
F7 P08709 1/20 0.46
TBXA2R P21731 1/20 0.46
PRSS3 P35030 1/20 0.46

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 SCHEMBL23454676 1.00 MASP2 (0.60) MASP2F2CYP3A4F11F10
Trifluoroacetic Acid SCHEMBL30131490 0.90 MASP2 (0.55) MASP2F2CYP3A4F11F10
Trifluoroacetic Acid SCHEMBL23452472 0.89 MASP2 (0.61) MASP2F2CYP3A4F11F10
Trifluoroacetic Acid SCHEMBL29880513 0.89 MASP2 (0.61) MASP2F2CYP3A4F11F10
Trifluoroacetic Acid SCHEMBL28587648 0.89 MASP2 (0.61) MASP2F2CYP3A4F11F10
Trifluoroacetic Acid SCHEMBL28587649 0.89 MASP2 (0.61) MASP2F2CYP3A4F11F10
SCHEMBL23454674 0.87 MASP2 (0.56) MASP2F2CYP3A4F11F10
Trifluoroacetic Acid SCHEMBL28864384 0.85 MASP2 (0.55) MASP2F2CYP3A4F11F10
Trifluoroacetic Acid SCHEMBL29880440 0.84 F2 (0.71) MASP2F2CYP3A4F11F10
SCHEMBL25054253 0.83 MASP2 (0.57) MASP2F2CYP3A4F11F10

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-11661418-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2023-05-30 US disclosed
WO-2021113690-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION (US) 2021-06-10 WO disclosed
US-20210171512-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2021-06-10 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 (2 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-20210171512-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 MASP2 1/4885F2 4221/4885CYP3A4 4706/4885
US-11661418-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 MASP2 1/4885F2 4221/4885CYP3A4 4706/4885

“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.