Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4358761

O=C(Nc1cc2cc(c1)OCCSc1cccc(c1)Nc1nc(ncc1Cl)N2)c1cccs1.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 11/20 0.39
JAK1 P23458 11/20 0.39
TYK2 P29597 11/20 0.39
JAK3 P52333 11/20 0.39
ALK Q9UM73 6/20 0.39
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
GRM4 Q14833 1/20 0.33

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
SCHEMBL1074649 0.95 JAK2 (0.42) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4356679 0.90 JAK2 (0.41) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4354803 0.90 JAK2 (0.41) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4365336 0.88 JAK2 (0.41) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4364665 0.88 JAK2 (0.41) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4358061 0.88 JAK2 (0.39) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4362012 0.87 JAK2 (0.38) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4358380 0.86 JAK2 (0.41) JAK2JAK1TYK2JAK3ALK
SCHEMBL1075519 0.85 JAK2 (0.44) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4356421 0.85 JAK2 (0.39) JAK2JAK1TYK2JAK3ALK

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 JAK2 1/4885JAK1 2/4885TYK2 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.