Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL523117

NC1(c2ccccc2OCCN(CCc2ccccc2)C(=O)O)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 2/20 0.37
LPAR5 Q9H1C0 2/20 0.37
KCNH2 Q12809 1/20 0.36
FAAH O00519 3/20 0.36
CES1 P23141 3/20 0.36
SLC1A2 P43004 1/20 0.35
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MLYCD O95822 1/20 0.34

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
SCHEMBL524535 0.94 MEN1 (0.39) LPAR1LPAR5MEN1NPC1RAB9A
Trifluoroacetic Acid SCHEMBL3468332 0.83 KDM4E (0.42) L3MBTL1
Trifluoroacetic Acid SCHEMBL523116 0.79 RBP4 (0.39)
SCHEMBL3466840 0.75 KDM4E (0.45) L3MBTL1
SCHEMBL19384155 0.73 HTR1D (0.56) L3MBTL1
SCHEMBL3468335 0.72 PDK2 (0.40)
Trifluoroacetic Acid SCHEMBL23327254 0.70 MRGPRX4 (0.45) NPC1L3MBTL1
SCHEMBL524022 0.69 LPAR1 (0.46) LPAR1LPAR5MEN1NPC1RAB9A
SCHEMBL16524239 0.69 ALDH1A1 (0.41) MEN1NPC1RAB9AKMT2ATDP1
SCHEMBL5933377 0.68 TDP1 (0.66) MEN1NPC1RAB9AKMT2ATDP1

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-8969350-B2 Pharmaceutical product comprising a p38 kinase inhibitor and a second active ingredient ASTRAZENECA AB (SE) 2015-03-03 US disclosed
US-20120028941-A1 Pharmaceutical Product Comprising a P38 Kinase Inhibitor and a Second Active Ingredient ASTRAZENECA UK LIMITED (GB) 2012-02-02 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-20120028941-A1 Pharmaceutical Product Comprising a P38 Kinase Inhibitor and a Second Active Ingredient NR3C2, ARRB1, GRK4 LPAR1 960/4885LPAR5 985/4885KCNH2 972/4885

“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.