Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6327439

Cc1ccc(-c2sc(-c3ccc(SC(C)(C)C(=O)O)cc3)nc2C(=O)Nc2ccc(N3CCOCC3)cc2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ TP53 P04637 2/20 0.46
▸ MAPK1 P28482 2/20 0.46
▸ PKM P14618 1/20 0.46
▸ DGAT1 O75907 3/20 0.45
▸ MAPT P10636 7/20 0.44
▸ ALDH1A1 P00352 5/20 0.44
▸ SLC2A1 P11166 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CHRNA7 P36544 1/20 0.41
▸ LMNA P02545 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ PIK3CA P42336 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ PIK3CG P48736 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ MITF O75030 1/20 0.40
▸ XBP1 P17861 1/20 0.40
▸ HTT P42858 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 SCHEMBL6328364 0.93 DGAT1 (0.44) NPC1RAB9ATP53MAPK1DGAT1
SCHEMBL6326588 0.92 DGAT1 (0.49) NPC1RAB9ATP53MAPK1DGAT1
Trifluoroacetic Acid SCHEMBL6332856 0.92 DGAT1 (0.43) NPC1RAB9ADGAT1MAPTALDH1A1
Trifluoroacetic Acid SCHEMBL6325794 0.91 NPC1 (0.42) NPC1RAB9ATP53MAPK1PKM
SCHEMBL6327445 0.90 MAPT (0.44) NPC1RAB9ATP53MAPK1PKM
Trifluoroacetic Acid SCHEMBL6334767 0.86 DGAT1 (0.47) NPC1RAB9ADGAT1MAPTALDH1A1
SCHEMBL5726776 0.85 DGAT1 (0.47) NPC1RAB9ATP53MAPK1DGAT1
SCHEMBL6335252 0.84 PPARA (0.49) NPC1TP53MAPK1MAPTALDH1A1
SCHEMBL6329108 0.84 HIPK4 (0.40) NPC1RAB9ATP53MAPK1MAPT
SCHEMBL5727205 0.84 DGAT1 (0.46) NPC1RAB9ATP53MAPK1DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014805-A1 Phenyl substituted 5-membered nitrogen containing heterocycles for the treatment of obesity BAYER PHARMACEUTICALS CORPORATION 2005-01-20 — — 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-20050014805-A1 Phenyl substituted 5-membered nitrogen containing heterocycles for the treatment of obesity GPR119, EGLN3, PC NPC1 315/4885RAB9A 2132/4885TP53 2790/4885

“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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