Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL13837151

COc1cnc2c(c1)c(C(C)=O)cn2CC(=O)O.O=C(O)C(F)(F)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 2/20 0.44
▸ MTNR1A P48039 4/20 0.40
▸ PKM P14618 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ HPGD P15428 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ PTGS2 P35354 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ PTGDR2 Q9Y5Y4 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MTNR1B P49286 2/20 0.33
▸ NR3C1 P04150 1/20 0.33
▸ AKR1A1 P14550 1/20 0.33
▸ AKR1B1 P15121 1/20 0.33
▸ LMNA P02545 1/20 0.33

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
SCHEMBL13967350 0.93 CFD (0.46) CFDMTNR1APKMKDM4EALDH1A1
SCHEMBL13837153 0.86 CFD (0.43) CFDMTNR1APKMKDM4EALDH1A1
SCHEMBL19233878 0.81 MTNR1A (0.46) CFDMTNR1APKMKDM4EALDH1A1
Trifluoroacetic Acid SCHEMBL13837183 0.74 KDM4E (0.43) CFDKDM4EALDH1A1RAB9ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL15542143 0.72 CFD (0.42) CFDMTNR1AKDM4EALDH1A1RAB9A
Trifluoroacetic Acid SCHEMBL12481205 0.71 CFD (0.42) CFDMTNR1APKMKDM4EALDH1A1
SCHEMBL12480373 0.71 ALDH1A1 (0.56) PKMKDM4EALDH1A1HPGDTSHR
SCHEMBL12480545 0.71 CFD (0.42) CFDKDM4EALDH1A1TSHRSMN1; SMN2
Trifluoroacetic Acid SCHEMBL12480789 0.70 KDM4E (0.50) CFDKDM4EALDH1A1TSHRSMN1; SMN2
Trifluoroacetic Acid SCHEMBL13837583 0.70 KDM4E (0.50) CFDKDM4EALDH1A1TSHRPTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2661433-B1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) NOVARTIS AG (CH) 2017-08-16 — — EP disclosed
US-9085555-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2015-07-21 — — US disclosed
US-20120295884-A1 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2012-11-22 — — 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-20120295884-A1 Complement pathway modulators and uses thereof C5, C3AR1, C9 CFD 9/4885MTNR1A 677/4885PKM 1477/4885

“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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