Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL924705

CC(=O)Nc1nc(C)c(-c2cnc(Cl)c(NC(=O)CCCN3CCOCC3)c2)s1.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 11)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 12/20 0.51
PIK3CB P42338 11/20 0.51
PIK3CG P48736 13/20 0.49
PIK3CD O00329 12/20 0.49
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
CLK1 P49759 1/20 0.46
RAB9A P51151 1/20 0.46
RIPK1 Q13546 1/20 0.42
PIK3C3 Q8NEB9 1/20 0.41

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
SCHEMBL924953 0.95 PIK3CA (0.56) PIK3CAPIK3CBPIK3CGPIK3CDNPC1
Trifluoroacetic Acid SCHEMBL925556 0.88 PIK3CB (0.57) PIK3CAPIK3CBPIK3CGPIK3CDPIK3C3
Trifluoroacetic Acid SCHEMBL925885 0.84 PIK3CB (0.56) PIK3CAPIK3CBPIK3CGPIK3CDRIPK1
Trifluoroacetic Acid SCHEMBL924653 0.82 PIK3CB (0.62) PIK3CAPIK3CBPIK3CGPIK3CDRIPK1
SCHEMBL924816 0.82 PIK3CB (0.63) PIK3CAPIK3CBPIK3CGPIK3CDPIK3C3
SCHEMBL926512 0.80 PIK3CB (0.67) PIK3CAPIK3CBPIK3CGPIK3CDRIPK1
Trifluoroacetic Acid SCHEMBL925978 0.80 PIK3CB (0.58) PIK3CAPIK3CBPIK3CGPIK3CDPIK3C3
Trifluoroacetic Acid SCHEMBL924714 0.79 RIPK1 (0.65) PIK3CAPIK3CBPIK3CGPIK3CDRIPK1
SCHEMBL925309 0.77 PIK3CB (0.62) PIK3CAPIK3CBPIK3CGPIK3CDRIPK1
Trifluoroacetic Acid SCHEMBL924675 0.76 PIK3CB (0.63) PIK3CAPIK3CBPIK3CGPIK3CDPIK3C3

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-7868188-B2 5-heteroaryl thiazoles and their use as PI3K inhibitors ASTRAZENECA AB (SE) 2011-01-11 US disclosed
EP-1841763-B1 5-HETEROARYL THIAZOLES AND THEIR USE AS PI3K INHIBITORS ASTRAZENECA AB (SE) 2010-06-30 EP disclosed
US-20080132502-A1 5-Heteroaryl Thiazoles And Their Use As PI3K Inhibitors ASTRAZENECA AB (SE) 2008-06-05 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-20080132502-A1 5-Heteroaryl Thiazoles And Their Use As PI3K Inhibitors MTOR, PIK3R5, PIK3CA PIK3CA 3/4885PIK3CB 18/4885PIK3CG 16/4885

“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.