Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1779645

O=C(Nc1cc(-c2cccc3[nH]ccc23)cc2[nH]ncc12)c1cccc(CN2CCN(C3CCCC3)CC2)n1.O=C(O)C(F)(F)F

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 9/20 0.55
PIK3CB P42338 7/20 0.55
PIK3CG P48736 7/20 0.55
PIM1 P11309 6/20 0.55
GSK3B P49841 6/20 0.55
PIK3CA P42336 6/20 0.55
DDR2 Q16832 1/20 0.40
HPGDS O60760 1/20 0.36
TRPV1 Q8NER1 3/20 0.36
CDK14 O94921 2/20 0.35
CCNY Q8ND76 2/20 0.35
ABL1 P00519 1/20 0.34
SRPK1 Q96SB4 1/20 0.34
S1PR1 P21453 1/20 0.34

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
SCHEMBL457137 0.95 PIK3CD (0.60) PIK3CDPIK3CBPIK3CGPIM1GSK3B
Trifluoroacetic Acid SCHEMBL1780544 0.95 PIK3CD (0.52) PIK3CDPIK3CBPIK3CGPIM1GSK3B
SCHEMBL459109 0.90 PIK3CD (0.57) PIK3CDPIK3CBPIK3CGPIM1GSK3B
Trifluoroacetic Acid SCHEMBL1781802 0.89 PIK3CD (0.54) PIK3CDPIK3CBPIK3CGPIM1GSK3B
Trifluoroacetic Acid SCHEMBL1782047 0.88 PIK3CD (0.56) PIK3CDPIK3CBPIK3CGPIM1GSK3B
Trifluoroacetic Acid SCHEMBL1780785 0.88 PIK3CD (0.56) PIK3CDPIK3CBPIK3CGPIM1GSK3B
Trifluoroacetic Acid SCHEMBL1780024 0.88 PIK3CD (0.56) PIK3CDPIK3CBPIK3CGPIM1GSK3B
Trifluoroacetic Acid SCHEMBL1780688 0.88 PIK3CD (0.56) PIK3CDPIK3CBPIK3CGPIM1GSK3B
Trifluoroacetic Acid SCHEMBL1781056 0.88 PIK3CD (0.55) PIK3CDPIK3CBPIK3CGPIM1GSK3B
Trifluoroacetic Acid SCHEMBL1781031 0.87 PIK3CD (0.54) PIK3CDPIK3CBPIK3CGPIM1GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8765743-B2 Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2014-07-01 US disclosed
US-20110118246-A1 Novel Compounds GLAXO GROUP LIMITED (GB) 2011-05-19 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-20110118246-A1 Novel Compounds PIK3CA, PIK3C2B, PIK3CD PIK3CD 3/4885PIK3CB 4/4885PIK3CG 9/4885

“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.