Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4843535

CC(C)C(CO)NCC(O)COc1ccc(-c2nc3cc(Br)cnc3[nH]2)cc1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ADRB1 P08588 3/20 0.38
ADRB2 P07550 1/20 0.38
HTR1A P08908 1/20 0.38
MAPT P10636 1/20 0.38
TRPV3 Q8NET8 1/20 0.37

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
SCHEMBL4838084 0.93 MAPT (0.43) ADRB1ADRB2MAPT
Trifluoroacetic Acid SCHEMBL4838285 0.92 ADRB1 (0.42) KDM4EMEN1ALDH1A1KMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL4834743 0.89 TRPV3 (0.39) TRPV3
Trifluoroacetic Acid SCHEMBL5260635 0.87
Trifluoroacetic Acid SCHEMBL4834992 0.84 HDAC3 (0.36)
SCHEMBL4834900 0.84 MAPT (0.45) ADRB1ADRB2MAPT
Trifluoroacetic Acid SCHEMBL4844208 0.83 CYP3A4 (0.46) KDM4EALDH1A1ADRB1ADRB2
Trifluoroacetic Acid SCHEMBL4834809 0.83 KMT2A (0.44) KDM4EMEN1ALDH1A1KMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL5258414 0.82 MEN1 (0.43) MEN1KMT2AADRB1ADRB2
Trifluoroacetic Acid SCHEMBL4834060 0.82 KDM4E (0.39) KDM4EMEN1ALDH1A1KMT2ASMN1; SMN2

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 KDM4E 2903/4885MEN1 2592/4885ALDH1A1 1489/4885

“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.