Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4359942

CN1CCCC1CCNC(=O)Nc1ccc2cc1CCc1cccc(c1)Nc1ncc(Cl)c(n1)N2.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 9/20 0.49
LCK P06239 1/20 0.40
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
METAP2 P50579 1/20 0.39
ADORA1 P30542 2/20 0.38
PDE4B Q07343 2/20 0.38
ADORA2A P29274 1/20 0.38
SLC2A1 P11166 1/20 0.38
CHRM3 P20309 2/20 0.37
ADORA2B P29275 1/20 0.36
JAK2 O60674 3/20 0.35
JAK1 P23458 3/20 0.35
TYK2 P29597 3/20 0.35
JAK3 P52333 3/20 0.35

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
SCHEMBL4366298 0.95 ALK (0.54) ALKLCKMETAP2ADORA1PDE4B
SCHEMBL13633121 0.88 ALK (0.43) ALKLCKMETAP2ADORA1PDE4B
Trifluoroacetic Acid SCHEMBL4359557 0.87 ALK (0.60) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL4359450 0.87 ALK (0.59) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL4359417 0.86 ALK (0.50) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL1075661 0.86 ALK (0.51) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL4361442 0.86 ALK (0.50) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL4354278 0.85 ALK (0.49) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL4365033 0.85 ALK (0.48) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL4364760 0.84 ALK (0.52) ALKLCKJAK2JAK1TYK2

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 ALK 3/4885LCK 13/4885CACNA1B 2005/4885

“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.