Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3013148

NC(=O)[C@H](NC(=O)CC(=O)Nc1cc(F)c(Oc2ccnc(N)c2)cc1F)c1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 14/20 0.48
▸ BRAF P15056 1/20 0.37
▸ MAPK14 Q16539 2/20 0.37
▸ KDR P35968 2/20 0.35
▸ NTRK1 P04629 1/20 0.35
▸ TEK Q02763 1/20 0.35
▸ NTRK3 Q16288 1/20 0.35
▸ NTRK2 Q16620 1/20 0.35
▸ ALOX5AP P20292 1/20 0.34
▸ FEN1 P39748 1/20 0.34
▸ AXL P30530 1/20 0.34
▸ MERTK Q12866 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
Trifluoroacetic Acid SCHEMBL1137638 1.00 MET (0.48) METBRAFMAPK14KDRNTRK1
SCHEMBL3003006 0.96 MET (0.52) METBRAFMAPK14KDRNTRK1
SCHEMBL1137672 0.96 MET (0.52) METBRAFMAPK14KDRNTRK1
SCHEMBL1137217 0.85 MET (0.52) METBRAFMAPK14
SCHEMBL1137271 0.84 MET (0.51) METBRAFMAPK14KDRNTRK1
SCHEMBL1137256 0.84 MET (0.69) METKDRAXL
SCHEMBL3006744 0.84 MET (0.69) METKDRAXL
SCHEMBL2997276 0.84 MET (0.69) METKDRAXL
SCHEMBL1137035 0.83 MET (0.49) METBRAFMAPK14KDRNTRK1
Trifluoroacetic Acid SCHEMBL1137637 0.82 MET (0.41) METBRAFMAPK14KDRNTRK1

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-20100183606-A1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-07-22 — — US disclosed
US-20090054436-A1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2009-02-26 — — 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-20090054436-A1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS CDK2, MAP3K19, CDK1 MET 162/4885BRAF 47/4885MAPK14 109/4885
US-20100183606-A1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS CDK2, MAP3K19, CDK1 MET 162/4885BRAF 47/4885MAPK14 109/4885

“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.

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