Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4360466

O=C(Nc1cccc(C(F)(F)F)c1)N1CCN(c2ccc3cc2CCc2cccc(c2)Nc2ncc(Cl)c(n2)N3)CC1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 8/20 0.61
TRPV1 Q8NER1 3/20 0.46
GOT1 P17174 1/20 0.45
FGFR4 P22455 1/20 0.44
LMNA P02545 4/20 0.41
HTT P42858 3/20 0.41
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KIT P10721 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL1076871 0.97 ALK (0.65) ALKTRPV1GOT1FGFR4LMNA
Trifluoroacetic Acid SCHEMBL4363168 0.94 ALK (0.63) ALKTRPV1GOT1LMNAHTT
Trifluoroacetic Acid SCHEMBL4371092 0.94 ALK (0.66) ALKTRPV1GOT1LMNAHTT
SCHEMBL1076611 0.92 ALK (0.67) ALKTRPV1GOT1MAPTKDM4E
Trifluoroacetic Acid SCHEMBL4360146 0.91 ALK (0.60) ALKSMN1; SMN2MAPK1HSD17B10
SCHEMBL1074091 0.89 ALK (0.72) ALKTRPV1GOT1
Trifluoroacetic Acid SCHEMBL4360985 0.89 ALK (0.61) ALKTRPV1GOT1KIT
Trifluoroacetic Acid SCHEMBL1076246 0.87 ALK (0.68) ALK
Trifluoroacetic Acid SCHEMBL4364315 0.87 ALK (0.66) ALKLMNAHTT
Trifluoroacetic Acid SCHEMBL4352327 0.86 ALK (0.72) 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 3/4885TRPV1 1707/4885GOT1 664/4885

“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.