Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6099585

Cc1cc(COc2ccc(Sc3cc(=O)[nH]c(=O)[nH]3)cc2)c2ccccc2n1.O=C(O)C(F)(F)F

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 8/20 0.51
MMP12 P39900 4/20 0.51
MMP13 P45452 3/20 0.51
MMP2 P08253 4/20 0.47
MMP3 P08254 2/20 0.47
MMP7 P09237 1/20 0.47
PKM P14618 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 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
SCHEMBL6101631 0.93 ADAM17 (0.54) ADAM17MMP12MMP13MMP2MMP3
Trifluoroacetic Acid SCHEMBL6099873 0.86 ADAM17 (0.51) ADAM17MMP12MMP13MMP2MMP3
SCHEMBL6099593 0.79 ADAM17 (0.46) ADAM17MMP12MMP13MMP2MMP3
SCHEMBL6101033 0.78 ADAM17 (0.52) ADAM17MMP12MMP13MMP2MMP3
Trifluoroacetic Acid SCHEMBL7401974 0.76 ADAM17 (0.56) ADAM17MMP12MMP13MMP2MMP3
Trifluoroacetic Acid SCHEMBL6099184 0.75 ADAM17 (0.61) ADAM17MMP12MMP13MMP2MMP3
SCHEMBL6099881 0.74 ADAM17 (0.45) ADAM17MMP12MMP13MMP2MMP3
Trifluoroacetic Acid SCHEMBL6101042 0.74 ADAM17 (0.57) ADAM17MMP12MMP13MMP2MMP3
Trifluoroacetic Acid SCHEMBL6136039 0.74 ADAM17 (0.48) ADAM17MMP12MMP13MMP2
Trifluoroacetic Acid SCHEMBL6136196 0.74 MMP12 (0.62) ADAM17MMP12MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7101883-B2 Uracil derivatives as inhibitors of TNF-α converting enzyme (TACE) and matrix metalloproteinases BRISTOL-MYERS SQUIBB COMPANY (US) 2006-09-05 US disclosed
US-20030229081-A1 Uracil derivatives as inhibitors of TNF-alpha converting enzyme (TACE) and matrix metalloproteinases BRISTOL-MYERS SQUIBB COMPANY 2003-12-11 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-20030229081-A1 Uracil derivatives as inhibitors of TNF-alpha converting enzyme (TACE) and matrix metalloproteinases UNG, IDUA, TNF ADAM17 26/4885MMP12 45/4885MMP13 29/4885

“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.