Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6290918

NCCCC[C@](N)(C(=O)Nc1ccc(C(c2ccc(NC(=O)[C@@](N)(CCCCN)C(=O)c3ccccc3)cc2)c2ccc(NC(=O)[C@@](N)(CCCCN)C(=O)c3ccccc3)cc2)cc1)C(=O)c1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 2/20 0.37
ABCC9 O60706 2/20 0.36
ABCC8 Q09428 2/20 0.36
KCNJ11 Q14654 2/20 0.36
PDK1 Q15118 2/20 0.36
PDK2 Q15119 2/20 0.36
PDK3 Q15120 2/20 0.36
KCNJ8 Q15842 2/20 0.36
PDK4 Q16654 2/20 0.36
ABCB11 O95342 1/20 0.36
RAB9A P51151 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LDHA P00338 2/20 0.35
LDHB P07195 2/20 0.35
CES1 P23141 1/20 0.35
NPC1 O15118 2/20 0.35
HDAC1 Q13547 3/20 0.34
HDAC7 Q8WUI4 2/20 0.34

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 SCHEMBL6287794 1.00 MLYCD (0.37) MLYCDABCC9ABCC8KCNJ11PDK1
Trifluoroacetic Acid SCHEMBL7038495 0.90 TP53 (0.35) ABCC9ABCC8KCNJ11KCNJ8RAB9A
Trifluoroacetic Acid SCHEMBL7039259 0.89 GABRB1 (0.40) MLYCDRAB9AMEN1KMT2ANPC1
Trifluoroacetic Acid SCHEMBL7039294 0.89 KLK1 (0.39) RAB9AMEN1KMT2AALDH1A1NPC1
Trifluoroacetic Acid SCHEMBL6288018 0.86 CES1 (0.39) RAB9ACES1NPC1HDAC1HDAC7
Trifluoroacetic Acid SCHEMBL6286281 0.86 CES1 (0.39) RAB9ACES1NPC1HDAC1HDAC7
Trifluoroacetic Acid SCHEMBL6286326 0.86 NR1H4 (0.37) RAB9AMEN1KMT2ANPC1KLK1
Trifluoroacetic Acid SCHEMBL6287884 0.82 KEAP1 (0.37) RAB9AMEN1KMT2AALDH1A1NPC1
Hydrochloric Acid SCHEMBL6285434 0.81 PLG (0.35) RAB9ANPC1HDAC1HDAC6KLK1
Hydrochloric Acid SCHEMBL6288039 0.81 RAB9A (0.44) RAB9AMEN1KMT2AALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887890-B2 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-05-03 US claimed
US-20030162724-A1 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-28 US claimed
EP-1291341-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-12 EP claimed
US-6887890-B2 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-05-03 US disclosed
US-20030162724-A1 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-28 US disclosed
EP-1291341-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-12 EP 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-20030162724-A1 Compounds exhibiting thrombopoietin-like activities MPL, THPO, TEK MLYCD 3969/4885ABCC9 3678/4885ABCC8 3174/4885

“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.