Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5111906

Cc1cccc(-c2ccccc2F)c1NC(=O)O.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CHIT1 Q13231 1/20 0.41
POLB P06746 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 1/20 0.39
GNRHR P30968 2/20 0.39
S1PR2 O95136 1/20 0.38
S1PR4 O95977 1/20 0.38
PDK1 Q15118 1/20 0.38
PDK2 Q15119 1/20 0.38
PDK3 Q15120 1/20 0.38
PDK4 Q16654 1/20 0.38
KDM4E B2RXH2 1/20 0.38
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
MGAM O43451 1/20 0.37

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 SCHEMBL5111875 0.82 KDM4E (0.46) SMN1; SMN2LMNAHTTNPSR1CHIT1
Trifluoroacetic Acid SCHEMBL5106740 0.81 CHRNA7 (0.42) SMN1; SMN2LMNAHTTNPSR1CHIT1
SCHEMBL5111908 0.81 NLRP3 (0.39) SMN1; SMN2LMNAHTTNPSR1POLB
Trifluoroacetic Acid SCHEMBL5112469 0.80 CHIT1 (0.41) RAB9ASMN1; SMN2LMNAHTTNPSR1
Trifluoroacetic Acid SCHEMBL5107141 0.80 HTT (0.41) SMN1; SMN2LMNAHTTNPSR1CHIT1
Trifluoroacetic Acid SCHEMBL5103332 0.78 CHRNA7 (0.47) SMN1; SMN2LMNAHTTNPSR1PDK1
Trifluoroacetic Acid SCHEMBL5100344 0.78 S1PR4 (0.46) SMN1; SMN2LMNAHTTNPSR1CHIT1
Trifluoroacetic Acid SCHEMBL5106657 0.76 S1PR4 (0.47) CHIT1S1PR2S1PR4PDK1PDK2
Trifluoroacetic Acid SCHEMBL3912140 0.75 RAB9A (0.43) RAB9ALMNACHIT1KMT2APDK2
Trifluoroacetic Acid SCHEMBL5106069 0.75 DHODH (0.44) RAB9ASMN1; SMN2CHIT1POLBALDH1A1

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-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists LAINE DRAMANE I 2008-10-09 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-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists CHRM3, CHRNG, CHRM2 RAB9A 2952/4885SMN1; SMN2 2627/4885LMNA 4137/4885

“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.