Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4352932

Cc1cc(C(=O)N2CCC(CC(=O)Nc3ccc4cc3CCc3cncc(c3)Nc3ncc(F)c(n3)N4)CC2)no1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.32

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.32
ALK Q9UM73 1/20 0.31
TACR2 P21452 1/20 0.30
TACR1 P25103 1/20 0.30
NAMPT P43490 1/20 0.30
JAK2 O60674 1/20 0.30
JAK1 P23458 1/20 0.30
TYK2 P29597 1/20 0.30
JAK3 P52333 1/20 0.30

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
Trifluoroacetic Acid SCHEMBL4360443 1.00 EPHX2 (0.32) EPHX2ALKTACR2TACR1NAMPT
SCHEMBL4356927 0.96 ALK (0.33) ALKTACR2TACR1NAMPTJAK2
Trifluoroacetic Acid SCHEMBL4362506 0.94 EPHX2 (0.32) EPHX2ALKNAMPTJAK2JAK1
Trifluoroacetic Acid SCHEMBL4357976 0.94 ALK (0.38) EPHX2ALKNAMPTJAK2JAK1
Trifluoroacetic Acid SCHEMBL4361373 0.93 ALK (0.37) EPHX2ALKTACR2TACR1JAK2
Trifluoroacetic Acid SCHEMBL4364456 0.91 ALK (0.37) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL4369734 0.91 ALK (0.37) ALKJAK2JAK1TYK2JAK3
SCHEMBL4354836 0.90 ALK (0.34) ALKNAMPTJAK2JAK1TYK2
SCHEMBL4357697 0.89 ALK (0.41) ALKNAMPTJAK2JAK1TYK2
SCHEMBL4370120 0.89 ALK (0.39) ALKTACR2TACR1JAK2

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-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 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-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS JAK2, JAK1, ALK EPHX2 4177/4885ALK 3/4885TACR2 3473/4885

“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.