Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4359492

O=C(CC1CCN(c2cnccn2)CC1)Nc1ccc2cc1CCc1cncc(c1)Nc1ncc(Cl)c(n1)N2.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40
JAK3 P52333 1/20 0.40
ALK Q9UM73 7/20 0.40
MAPT P10636 2/20 0.37
POLB P06746 1/20 0.34
KDM4E B2RXH2 2/20 0.33
FFAR4 Q5NUL3 1/20 0.33
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
DEGS1 O15121 1/20 0.33
CNR1 P21554 1/20 0.32
NAMPT P43490 1/20 0.32

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
SCHEMBL1073115 0.95 JAK2 (0.44) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4365384 0.93 ALDH1A1 (0.41) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4352958 0.92 ALK (0.40) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4359010 0.91 ALK (0.41) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL1073397 0.91 ALK (0.42) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4357865 0.91 ALK (0.39) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL1074523 0.91 ALK (0.40) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4359367 0.90 ALK (0.42) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4354730 0.90 ALK (0.39) JAK2JAK1TYK2JAK3ALK
Trifluoroacetic Acid SCHEMBL4365346 0.90 ALK (0.43) 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.