Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL13387751

COC(=O)c1cc(NC(=O)c2cc(NC(=O)c3cc(N)n[nH]3)n[nH]2)n[nH]1.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.43
ALPL P05186 9/20 0.41
MAPT P10636 5/20 0.41
RAB9A P51151 3/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 2/20 0.39
LMNA P02545 1/20 0.39
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
CCNA1 P78396 1/20 0.38
CSNK2A2 P19784 1/20 0.36
CSNK2A1 P68400 1/20 0.36
HPGDS O60760 1/20 0.36

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
SCHEMBL14397331 0.91 MAPK1 (0.50) GAAMAPK1ALPLMAPTRAB9A
SCHEMBL14397160 0.79 HCAR3 (0.47) ALPLMAPTRAB9ANPC1CCNA2
SCHEMBL286531 0.79 MAPK1 (0.65) GAAMAPK1ALPLMAPTRAB9A
Hydrochloric Acid SCHEMBL286530 0.77 MAPK1 (0.62) GAAMAPK1ALPLMAPTRAB9A
SCHEMBL23854654 0.72 MAPK1 (0.59) GAAMAPK1ALPLMAPTRAB9A
SCHEMBL16534089 0.69 MAPK1 (0.51) GAAMAPK1ALPLMAPTRAB9A
SCHEMBL1662796 0.67 CHEK1 (0.56) GAAMAPK1ALPLMAPTLMNA
SCHEMBL23513527 0.67 NPC1 (0.55) RAB9ASMN1; SMN2NPC1LMNACCNA2
SCHEMBL1498628 0.66 MAPK1 (0.59) GAAMAPK1ALPLMAPTRAB9A
SCHEMBL25426462 0.64 NPC1 (0.59) MAPTRAB9APOLBSMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481494-B2 Compounds for the treatment of diseases related to protein misfolding UNIVERSITAT DUISBURG-ESSEN (DE) 2013-07-09 US disclosed
US-20120270795-A1 COMPOUNDS FOR THE TREATMENT OF DISEASES RELATED TO PROTEIN MISFOLDING UNIVERSITAT DUISBURG-ESSEN (DE) 2012-10-25 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-20120270795-A1 COMPOUNDS FOR THE TREATMENT OF DISEASES RELATED TO PROTEIN MISFOLDING APP, PRNP, PSEN1 GAA 101/4885MAPK1 1482/4885ALPL 4781/4885

“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.