Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7316949

COc1c(CCN)c2cc(-c3ccc(C#N)cc3)ccc2n1Cc1ccc(Cl)c(Cl)c1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 2/20 0.40
CCR2 P41597 11/20 0.40
PLA2G2A P14555 1/20 0.37
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
PTGES2 Q9H7Z7 3/20 0.36
PTGES O14684 1/20 0.36
ADAM17 P78536 1/20 0.36

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 SCHEMBL7315970 0.93 CCR2 (0.41) ABCB11CCR2PLA2G2AGRIN1GRIN2B
Trifluoroacetic Acid SCHEMBL7318205 0.87 ICMT (0.41) PLA2G2AGRIN1GRIN2B
Trifluoroacetic Acid SCHEMBL7312753 0.83 MDM2 (0.39) PLA2G2AGRIN1GRIN2BPTGES2PTGES
Trifluoroacetic Acid SCHEMBL7585777 0.72 EGFR (0.46) PLA2G2A
Trifluoroacetic Acid SCHEMBL7402879 0.72 KDM1A (0.33) GRIN1GRIN2B
Trifluoroacetic Acid SCHEMBL7321085 0.70 EGFR (0.47) PLA2G2A
Trifluoroacetic Acid SCHEMBL7400482 0.66 HCRTR1 (0.36)
Trifluoroacetic Acid SCHEMBL6379652 0.66 TAAR1 (0.68)
Trifluoroacetic Acid SCHEMBL7320998 0.65 EGFR (0.47) PLA2G2A
Trifluoroacetic Acid SCHEMBL7307520 0.64 PTGDR2 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010007877-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION 2001-07-12 US claimed
WO-2001034146-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION (US) 2001-05-17 WO claimed
US-20020004198-A1 Novel anti-infectives SMITHKLINE BEECHAM CORPORATION 2002-01-10 US disclosed
US-20010007877-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION 2001-07-12 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-20010007877-A1 NOVEL ANTI-INFECTIVES CTSL, MMP8, SERPINB1 ABCB11 1769/4885CCR2 384/4885PLA2G2A 2102/4885

“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.