Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4841466

Cc1nc[nH]c1CNc1ccc(-c2nc3cc(Br)cnc3[nH]2)cc1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
MMP2 P08253 4/20 0.35
MMP9 P14780 4/20 0.35
MMP8 P22894 4/20 0.35
MMP13 P45452 4/20 0.35
HPSE Q9Y251 6/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33
FFAR1 O14842 3/20 0.33
DGAT1 O75907 1/20 0.32
EGFR P00533 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL5259949 0.91 NPC1 (0.39) NPC1RAB9AKMT2AMMP2MMP9
Trifluoroacetic Acid SCHEMBL4846619 0.84 MMP2 (0.35) NPC1RAB9AKMT2AMMP2MMP9
Trifluoroacetic Acid SCHEMBL4845870 0.84 TAAR1 (0.41) HPSE
Trifluoroacetic Acid SCHEMBL4835219 0.83 KMT2A (0.38) NPC1RAB9AKMT2AMMP2MMP9
Trifluoroacetic Acid SCHEMBL4838725 0.82 MMP2 (0.34) NPC1RAB9AKMT2AMMP2MMP9
Trifluoroacetic Acid SCHEMBL4841657 0.82 TAAR1 (0.41) NPC1RAB9AKMT2AMMP2MMP9
Trifluoroacetic Acid SCHEMBL4845670 0.81 FFAR1 (0.42) HPSEFFAR1DGAT1
Trifluoroacetic Acid SCHEMBL5259763 0.81 MMP2 (0.35) NPC1RAB9AKMT2AMMP2MMP9
Trifluoroacetic Acid SCHEMBL4839090 0.81 GPR6 (0.43) MMP2MMP9MMP8MMP13FFAR1
Trifluoroacetic Acid SCHEMBL4837278 0.81 HPSE (0.45) NPC1RAB9AKMT2AHPSEFFAR1

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-7410966-B2 Use of and some novel imidazopyridines ASTRAZENECA AB (SE) 2008-08-12 US disclosed
EP-1539759-B1 NOVEL IMIDAZOPYRIDINES AND THEIR USE ASTRAZENECA AB (SE) 2007-08-15 EP disclosed
US-20050261333-A1 Use of and some novel imidazopyridines ASTRAZENECA A B (SE) 2005-11-24 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-20050261333-A1 Use of and some novel imidazopyridines ITK, CSNK1A1, RPS6KA1 NPC1 2655/4885RAB9A 1616/4885KMT2A 2697/4885

“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.