Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3681765

C[N+](C)(C)C[C@@H](CC(=O)O)NC(=O)c1ccc(CS(=O)(=O)Cc2ccccc2)o1.O=C([O-])C(F)(F)F

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
SMN1; SMN2 Q16637 5/20 0.45
TP53 P04637 2/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
LMNA P02545 2/20 0.41
USP2 O75604 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
POLB P06746 2/20 0.40
MAPT P10636 1/20 0.40

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
Trifluoroacetic Acid SCHEMBL3681770 1.00 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2TP53KMT2AMEN1
Trifluoroacetic Acid SCHEMBL3681762 0.94 SMN1; SMN2 (0.46) ALDH1A1SMN1; SMN2TP53KMT2AMEN1
SCHEMBL13409971 0.92 SMN1; SMN2 (0.51) ALDH1A1SMN1; SMN2TP53KMT2AMEN1
SCHEMBL3681769 0.86 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2TP53KMT2AMEN1
SCHEMBL14822999 0.81 SMN1; SMN2 (0.59) ALDH1A1SMN1; SMN2TP53KMT2AMEN1
Trifluoroacetic Acid SCHEMBL3682673 0.78 S1PR1 (0.40) ALDH1A1
Trifluoroacetic Acid SCHEMBL3682670 0.78 S1PR1 (0.40) ALDH1A1
SCHEMBL13444465 0.78 HPGD (0.43) ALDH1A1SMN1; SMN2TP53KMT2AMEN1
Trifluoroacetic Acid SCHEMBL3688864 0.78 POLB (0.32) ALDH1A1POLB
Trifluoroacetic Acid SCHEMBL3688859 0.78 POLB (0.32) ALDH1A1POLB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008109991-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK (CA) 2008-09-18 WO claimed
US-8410150-B2 Inhibitors of carnitine palmitoyltransferase and treating cancer UNIVERSITY HEALTH NETWORK (CA) 2013-04-02 US disclosed
US-20100105900-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK 2010-04-29 US disclosed
WO-2008109991-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK (CA) 2008-09-18 WO 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-20100105900-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER CPT1A, CPT1B, CPT2 ALDH1A1 236/4885SMN1; SMN2 1205/4885TP53 1289/4885

“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.