Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL979474

C[N+]1(C)CCCC(CC(=O)O)(NC(=O)c2ccc(CCc3ccccc3)o2)C1.O=C([O-])C(F)(F)F

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.33
▸ POLB P06746 1/20 0.33
▸ TAAR1 Q96RJ0 2/20 0.33
▸ PRSS1 P07477 1/20 0.33
▸ PRSS2 P07478 1/20 0.33
▸ PRSS3 P35030 1/20 0.33
▸ LPAR1 Q92633 1/20 0.32
▸ GNRHR P30968 1/20 0.32
▸ GSR P00390 1/20 0.32
▸ LMNA P02545 4/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ ADRB2 P07550 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL12923331 0.93 TAAR1 (0.36) ALDH1A1POLBTAAR1PRSS1PRSS2
Trifluoroacetic Acid SCHEMBL978104 0.89 ALDH1A1 (0.35) ALDH1A1POLBTAAR1PRSS1PRSS2
Iodide SCHEMBL15590042 0.84 CTDSP1 (0.34) ALDH1A1POLBTAAR1PRSS1PRSS2
SCHEMBL12923305 0.81 TAAR1 (0.39) ALDH1A1POLBTAAR1PRSS1PRSS2
Trifluoroacetic Acid SCHEMBL980207 0.77 SLC6A9 (0.37) ALDH1A1TAAR1PRSS1PRSS2PRSS3
SCHEMBL12923328 0.74 PRSS1 (0.38) POLBTAAR1PRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL978175 0.73 KDM4E (0.42) ALDH1A1POLBPRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL978924 0.72 AKT1 (0.39) ALDH1A1LMNASMN1; SMN2
Iodide SCHEMBL977791 0.70 GAA (0.37) ALDH1A1POLBTAAR1GNRHRLMNA
Trifluoroacetic Acid SCHEMBL978194 0.69 CA12 (0.36) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8680282-B2 Cyclic inhibitors of carnitine palmitoyltransferase and treating cancer UNIVERSITY HEALTH NETWORK (CA) 2014-03-25 — — US disclosed
US-20110015174-A1 CYCLIC INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK (CA) 2011-01-20 — — US disclosed
WO-2009015485-A1 CYCLIC INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK (CA) 2009-02-05 — — 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-20110015174-A1 CYCLIC INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER CPT1A, CPT1B, CPT2 ALDH1A1 196/4885POLB 1444/4885TAAR1 3335/4885

“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.

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