Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4369635

O=C(Nc1ccc2cc1CCc1cccc(c1)Nc1ncc(Cl)c(n1)N2)N[C@H]1CCN(Cc2ccccc2)C1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 4/20 0.47
DCUN1D1 Q96GG9 4/20 0.41
UBE2M P61081 3/20 0.41
CDK14 O94921 4/20 0.40
CCNY Q8ND76 4/20 0.40
DRD4 P21917 2/20 0.40
SIGMAR1 Q99720 1/20 0.40
CCR3 P51677 3/20 0.39
CCR2 P41597 1/20 0.38
DRD2 P14416 1/20 0.38

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
SCHEMBL1073443 0.96 ALK (0.51) ALKDCUN1D1UBE2MDRD4SIGMAR1
Trifluoroacetic Acid SCHEMBL1076552 0.90 ALK (0.48) ALKCDK14CCNY
Trifluoroacetic Acid SCHEMBL4358301 0.89 ALK (0.54) ALK
Trifluoroacetic Acid SCHEMBL4361604 0.89 ALK (0.50) ALK
Trifluoroacetic Acid SCHEMBL4360830 0.89 ALK (0.50) ALK
Trifluoroacetic Acid SCHEMBL4358088 0.88 ALK (0.51) ALK
Trifluoroacetic Acid SCHEMBL4358255 0.88 ALK (0.47) ALKCDK14CCNY
Trifluoroacetic Acid SCHEMBL4364663 0.88 ALK (0.47) ALKCDK14CCNY
Trifluoroacetic Acid SCHEMBL4356671 0.88 ALK (0.48) ALKCDK14CCNY
Trifluoroacetic Acid SCHEMBL4364370 0.88 ALK (0.49) ALK

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 3/4885DCUN1D1 2819/4885UBE2M 2453/4885

“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.