Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2017034

CC(Nc1ncnc2[nH]cnc12)c1nc2ccc(Cl)cn2c1-c1cccc(F)c1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 19/20 0.48
PIK3R1 P27986 7/20 0.45
PIK3CB P42338 7/20 0.45
PIK3CG P48736 7/20 0.45
MERTK Q12866 1/20 0.39
AXL P30530 1/20 0.39

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
SCHEMBL2017292 0.93 PIK3CD (0.52) PIK3CDPIK3R1PIK3CBPIK3CG
Trifluoroacetic Acid SCHEMBL2247937 0.92 PIK3CD (0.49) PIK3CDPIK3R1PIK3CBPIK3CGMERTK
Trifluoroacetic Acid SCHEMBL2247226 0.87 PIK3CD (0.48) PIK3CDPIK3R1PIK3CBPIK3CGMERTK
Trifluoroacetic Acid SCHEMBL2251492 0.86 PIK3CD (0.44) PIK3CDPIK3R1PIK3CBPIK3CGMERTK
Trifluoroacetic Acid SCHEMBL2052472 0.85 PIK3CD (0.43) PIK3CDPIK3R1PIK3CBPIK3CGMERTK
SCHEMBL2013893 0.84 PIK3CD (0.53) PIK3CDPIK3R1PIK3CBPIK3CGMERTK
Trifluoroacetic Acid SCHEMBL2245485 0.83 PIK3CD (0.43) PIK3CDPIK3R1PIK3CBPIK3CGMERTK
Trifluoroacetic Acid SCHEMBL2053563 0.82 PIK3CD (0.45) PIK3CDPIK3R1PIK3CBPIK3CGMERTK
SCHEMBL2016694 0.82 PIK3CD (0.46) PIK3CDPIK3R1PIK3CBPIK3CGMERTK
SCHEMBL2054056 0.81 PIK3CD (0.54) PIK3CDPIK3R1PIK3CBPIK3CGMERTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9403847-B2 Substituted heteroaryl fused derivatives as P13K inhibitors INCYTE HOLDINGS CORPORATION (US) 2016-08-02 US disclosed
US-20140275127-A1 SUBSTITUTED HETEROARYL FUSED DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2014-09-18 US disclosed
US-8759359-B2 Substituted heteroaryl fused derivatives as PI3K inhibitors INCYTE CORPORATION (US) 2014-06-24 US disclosed
US-20110190319-A1 SUBSTITUTED HETEROARYL FUSED DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION 2011-08-04 US disclosed
WO-2011075643-A1 SUBSTITUTED HETEROARYL FUSED DERIVATIVES AS PI3K INHIBITORS INCYTE CORPORATION (US) 2011-06-23 WO 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 (2 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-20110190319-A1 SUBSTITUTED HETEROARYL FUSED DERIVATIVES AS PI3K INHIBITORS PIK3CA, PIK3CD, PIK3R5 PIK3CD 2/4885PIK3R1 11/4885PIK3CB 6/4885
US-20140275127-A1 SUBSTITUTED HETEROARYL FUSED DERIVATIVES AS PI3K INHIBITORS PIK3CA, PIK3CD, PIK3R5 PIK3CD 2/4885PIK3R1 11/4885PIK3CB 6/4885

“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.