Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2959529

O=C(O)C(F)(F)F.O=c1c2c(cnn1CCOc1ccccc1)nc(N1CCNCC1)n2Cc1ccccc1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 3/20 0.48
DPP4 P27487 5/20 0.47
HTR2C P28335 1/20 0.45
CHRM1 P11229 2/20 0.45
SOS1 Q07889 1/20 0.44
NPC1 O15118 1/20 0.42
MITF O75030 1/20 0.42
PKM P14618 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL13200868 0.93 HTR3A (0.54) HTR3ADPP4HTR2CCHRM1SOS1
Trifluoroacetic Acid SCHEMBL2958554 0.91 DPP4 (0.49) HTR3ADPP4CHRM1SOS1
Trifluoroacetic Acid SCHEMBL2962532 0.89 HTR3A (0.51) HTR3ADPP4CHRM1SOS1
Trifluoroacetic Acid SCHEMBL2963765 0.89 DPP4 (0.50) HTR3ADPP4CHRM1SOS1
SCHEMBL2963767 0.88 DPP4 (0.48) HTR3ADPP4CHRM1SOS1
Trifluoroacetic Acid SCHEMBL2957732 0.88 DPP4 (0.58) DPP4HTR2CCHRM1
Trifluoroacetic Acid SCHEMBL2965733 0.87 HTR3A (0.51) HTR3ADPP4CHRM1SOS1
Trifluoroacetic Acid SCHEMBL2965269 0.84 DPP4 (0.55) HTR3ADPP4SOS1
SCHEMBL13217574 0.84 HTR2C (0.53) HTR3ADPP4HTR2CCHRM1NPC1
Trifluoroacetic Acid SCHEMBL2968179 0.84 DPP4 (0.50) HTR3ADPP4CHRM1SOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7772226-B2 Condensed imidazole derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-10 US disclosed
US-20090018331-A1 CONDENSED IMIDAZOLE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-01-15 US disclosed
US-20060100199-A1 Novel condensed imidazole derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2006-05-11 US disclosed
US-20060063787-A1 Condensed imidazole derivatives EISAI CO., LTD. (JP) 2006-03-23 US disclosed
EP-1514552-A1 NOVEL FUSED IMIDAZOLE DERIVATIVE Eisai Co., Ltd. (JP) 2005-03-16 EP disclosed
US-20040116328-A1 Condensed imidazole derivatives EISAI CO., LTD. (JP) 2004-06-17 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 (3 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-20060100199-A1 Novel condensed imidazole derivatives H1-2, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, H1-4 HTR3A 2063/4885DPP4 4422/4885HTR2C 805/4885
US-20060063787-A1 Condensed imidazole derivatives DPP4, HDAC1, DPP7 HTR3A 1879/4885DPP4 1/4885HTR2C 1288/4885
US-20090018331-A1 CONDENSED IMIDAZOLE DERIVATIVES DPP4, HDAC1, DPP7 HTR3A 1879/4885DPP4 1/4885HTR2C 1288/4885

“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.