Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL29627985

O=C(O)C(F)(F)F.c1ccc2c(c1)ncc1nc[nH]c12

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
PDPK1 O15530 1/20 0.45
CA12 O43570 1/20 0.45
ALOX15 P16050 1/20 0.45
CA9 Q16790 1/20 0.45
TNKS2 Q9H2K2 1/20 0.45
TLR7 Q9NYK1 1/20 0.38
JAK2 O60674 2/20 0.37
DYRK1A Q13627 2/20 0.37
CLK1 P49759 1/20 0.36
CLK2 P49760 1/20 0.36
GSK3B P49841 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36
DYRK1B Q9Y463 1/20 0.36
TACR1 P25103 1/20 0.35
ERN1 O75460 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35

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
Acetic Acid SCHEMBL10727228 0.87 SMN1; SMN2 (0.49) PARP1SMN1; SMN2PDPK1CA12ALOX15
Acetic Acid SCHEMBL10742452 0.85 SMN1; SMN2 (0.47) PARP1SMN1; SMN2PDPK1CA12ALOX15
SCHEMBL29508386 0.84 PDPK1 (0.55) PARP1SMN1; SMN2PDPK1CA12ALOX15
SCHEMBL202156 0.84 PDPK1 (0.55) PARP1SMN1; SMN2PDPK1CA12ALOX15
Ammonia Solution, Strong SCHEMBL4824906 0.83 PDPK1 (0.53) PARP1SMN1; SMN2PDPK1CA12ALOX15
Hydrochloric Acid SCHEMBL4766699 0.83 PDPK1 (0.53) PARP1SMN1; SMN2PDPK1CA12ALOX15
SCHEMBL10427747 0.83 PDPK1 (0.53) PARP1SMN1; SMN2PDPK1CA12ALOX15
Formic Acid SCHEMBL10727380 0.82 PDPK1 (0.50) PARP1SMN1; SMN2PDPK1CA12ALOX15
Formic Acid SCHEMBL10738924 0.81 PDPK1 (0.49) PARP1SMN1; SMN2PDPK1CA12ALOX15
Quinazolinone SCHEMBL31483770 0.81 PARP1 (0.72) PARP1SMN1; SMN2PDPK1CA12ALOX15

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-11312713-B2 Imidazo[4,5-C]quinoline derivatives as LRRK2 inhibitors PFIZER INC. (US) 2022-04-26 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-11312713-B2 Imidazo[4,5-C]quinoline derivatives as LRRK2 inhibitors LRRK2, PARK7, BRCA1 PARP1 647/4885SMN1; SMN2 816/4885PDPK1 390/4885

“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.