Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4510960

Cc1cc(C)nc(NC(=O)N2CCOC(COc3ccnc(C)n3)C2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 7/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GRM5 P41594 3/20 0.36
BRAF P15056 2/20 0.36
TRPV1 Q8NER1 1/20 0.36
LOXL2 Q9Y4K0 1/20 0.36
PDK1 Q15118 1/20 0.35
ABL1 P00519 1/20 0.35

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 SCHEMBL4515416 0.89 GRM5 (0.43) PHGDHGRM5TRPV1LOXL2PDK1
Trifluoroacetic Acid SCHEMBL4503751 0.88 DRD4 (0.45) PHGDHGRM5TRPV1LOXL2
Trifluoroacetic Acid SCHEMBL4501514 0.87 PDK1 (0.47) PHGDHNPC1RAB9ATDP1GRM5
Trifluoroacetic Acid SCHEMBL4505112 0.85 GRM5 (0.45) PHGDHNPC1RAB9ATDP1GRM5
Trifluoroacetic Acid SCHEMBL4505929 0.85 CYP1A2 (0.48) PHGDHNPC1RAB9ATDP1GRM5
Trifluoroacetic Acid SCHEMBL4495237 0.84 TRPV1 (0.40) PHGDHGRM5TRPV1PDK1
Trifluoroacetic Acid SCHEMBL4516194 0.84 GRM5 (0.40) PHGDHGRM5TRPV1PDK1ABL1
Trifluoroacetic Acid SCHEMBL4493583 0.84 GRM5 (0.41) PHGDHNPC1RAB9ATDP1GRM5
Trifluoroacetic Acid SCHEMBL4516133 0.84 EPHA2 (0.41) PHGDHGRM5TRPV1
Trifluoroacetic Acid SCHEMBL4505237 0.83 TRPV1 (0.39) PHGDHGRM5TRPV1PDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325956-A1 Aromatic amine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-31 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-20090325956-A1 Aromatic amine derivative and use thereof SCD, SCD5, SMS PHGDH 1406/4885NPC1 57/4885RAB9A 3368/4885

“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.