Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4842220

Cc1cnc2[nH]c(-c3ccc(N(C)C)cc3)nc2c1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 10/20 0.51
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
GUSB P08236 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
TCF4 P15884 1/20 0.44
CTNNB1 P35222 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
KIF11 P52732 1/20 0.40
CCNB2 O95067 1/20 0.38
CDK1 P06493 1/20 0.38
CCNB1 P14635 1/20 0.38
GSK3A P49840 1/20 0.38
GSK3B P49841 1/20 0.38
CCNB3 Q8WWL7 1/20 0.38
PARP1 P09874 1/20 0.38
NOX1 Q9Y5S8 1/20 0.38
CHEK2 O96017 1/20 0.38

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
SCHEMBL27634265 0.88 AURKA (0.63) AURKAKDM4ENPC1GUSBMAPT
Trifluoroacetic Acid SCHEMBL4842729 0.88 AURKA (0.52) AURKAKDM4ENPC1GUSBMAPT
Trifluoroacetic Acid SCHEMBL4839654 0.82 HDAC3 (0.48) MAPTCHEK2PDE2A
SCHEMBL27641813 0.76 AURKA (0.45) AURKAMAPTTCF4CTNNB1SIRT2
Trifluoroacetic Acid SCHEMBL4840939 0.75 CHEK2 (0.47) KDM4ENPC1GUSBRAB9APARP1
SCHEMBL987859 0.74 AURKA (0.50) AURKAKDM4ENPC1GUSBMAPT
SCHEMBL9693787 0.73 MAPK1 (0.48) AURKAKDM4ENPC1GUSBMAPT
Trifluoroacetic Acid SCHEMBL4834909 0.72 HDAC6 (0.47) KDM4EMAPTCHEK2PDE2A
Trifluoroacetic Acid SCHEMBL4842876 0.72 CHEK2 (0.45) KDM4ENPC1GUSBRAB9APARP1
SCHEMBL984310 0.72 NPC1 (0.46) AURKAKDM4ENPC1GUSBMAPT

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 AURKA 512/4885KDM4E 2903/4885NPC1 2655/4885

“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.