Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5145437

NC1CCN(C(=O)N2CCOCC2)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.46
KMT2A Q03164 1/20 0.46
AKR1C3 P42330 4/20 0.42
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 1/20 0.40
DPP4 P27487 1/20 0.40
DPP8 Q6V1X1 1/20 0.40
TSHR P16473 1/20 0.40
RECQL P46063 1/20 0.38
USP2 O75604 1/20 0.38
PKM P14618 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
SCHEMBL2437206 0.88 MEN1 (0.57) MEN1TP53KMT2AAKR1C3CYP2C9
SCHEMBL2688487 0.80 MEN1 (0.52) MEN1TP53KMT2AAKR1C3CYP2C9
SCHEMBL2445342 0.80 MEN1 (0.52) MEN1TP53KMT2AAKR1C3CYP2C9
SCHEMBL2445340 0.80 MEN1 (0.52) MEN1TP53KMT2AAKR1C3CYP2C9
Trifluoroacetic Acid SCHEMBL29191950 0.78 CHRM2 (0.44) DPP4DPP8
Trifluoroacetic Acid SCHEMBL1700180 0.77 L3MBTL1 (0.39) SMN1; SMN2DPP4DPP8
Trifluoroacetic Acid SCHEMBL21645222 0.77 L3MBTL1 (0.39) SMN1; SMN2DPP4DPP8
Trifluoroacetic Acid SCHEMBL9066267 0.77 CA2 (0.48) MEN1TP53KMT2AAKR1C3CYP2C9
SCHEMBL1136825 0.76 GNAI3 (0.46) MEN1TP53KMT2ADPP4
Trifluoroacetic Acid SCHEMBL23535368 0.76 DPP7 (0.41) DPP4DPP8

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-20070238734-A1 JNK INHIBITORS SANOLI-AVENTIS (FR) 2007-10-11 US disclosed
US-20050009831-A1 Pyrrolo[1,2-a]pyrazine-8-carboxamides are JNK inhibitors, useful as anticarcinogenic agents AVENTIS PHARMA S.A, (FR) 2005-01-13 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 (2 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-20070238734-A1 JNK INHIBITORS MAP3K7, MAPKAPK2, MAPK7 MEN1 3865/4885TP53 519/4885KMT2A 2686/4885
US-20050009831-A1 Pyrrolo[1,2-a]pyrazine-8-carboxamides are JNK inhibitors, useful as anticarcinogenic agents CNKSR1, ROS1, NRAS MEN1 3716/4885TP53 255/4885KMT2A 1910/4885

“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.