Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3148336

Nc1ccc(CNC(=O)[C@@H](N)Cc2ccc(F)c(F)c2)cn1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.47
MASP2 O00187 1/20 0.43
DPP4 P27487 1/20 0.42
KCNH2 Q12809 1/20 0.42
OPRK1 P41145 7/20 0.42
NAMPT P43490 2/20 0.41
HDAC1 Q13547 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
SCHEMBL1901467 0.94 PDPK1 (0.47) PDPK1MASP2NAMPTHDAC1
SCHEMBL1901471 0.94 PDPK1 (0.47) PDPK1MASP2NAMPTHDAC1
Hydrochloric Acid SCHEMBL1432707 0.92 PDPK1 (0.46) PDPK1MASP2NAMPTHDAC1
Hydrochloric Acid SCHEMBL1432702 0.92 PDPK1 (0.46) PDPK1MASP2NAMPTHDAC1
Trifluoroacetic Acid SCHEMBL1434678 0.87 OPRK1 (0.46) MASP2OPRK1NAMPT
SCHEMBL1431758 0.85 KLKB1 (0.49) PDPK1MASP2OPRK1NAMPT
SCHEMBL3149440 0.85 KLKB1 (0.49) PDPK1MASP2OPRK1NAMPT
SCHEMBL1903911 0.83 NAMPT (0.54) MASP2NAMPT
SCHEMBL1903909 0.83 NAMPT (0.54) MASP2NAMPT
SCHEMBL3148328 0.82 PDPK1 (0.47) PDPK1MASP2NAMPTHDAC1

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-20100076015-A1 Aminopyridine Derivatives VANTIA LIMITED (GB) 2010-03-25 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-20100076015-A1 Aminopyridine Derivatives CHRM1, ARG1, ARG2 PDPK1 1972/4885MASP2 3039/4885DPP4 1063/4885

“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.