Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6161851

CCOC(=O)c1cn(Cc2cccc(C=NN)c2)cc1Cc1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 3/20 0.38
PDE3A Q14432 3/20 0.38
TSHR P16473 2/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 3/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
RAB9A P51151 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
TP53 P04637 1/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
POLB P06746 1/20 0.34
MEN1 O00255 1/20 0.34
ACHE P22303 1/20 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 SCHEMBL6161844 1.00 PDE3B (0.38) PDE3BPDE3ATSHRSMN1; SMN2KMT2A
Trifluoroacetic Acid SCHEMBL6166091 0.96 TSHR (0.39) PDE3BPDE3ATSHRSMN1; SMN2KMT2A
Trifluoroacetic Acid SCHEMBL6166096 0.96 TSHR (0.39) PDE3BPDE3ATSHRSMN1; SMN2KMT2A
Trifluoroacetic Acid SCHEMBL7106592 0.94 GRM2 (0.34) PDE3BPDE3ATSHRSMN1; SMN2KMT2A
Trifluoroacetic Acid SCHEMBL7106589 0.94 GRM2 (0.34) PDE3BPDE3ATSHRSMN1; SMN2KMT2A
Trifluoroacetic Acid SCHEMBL6164613 0.93 PDE3B (0.34) PDE3BPDE3ATSHRSMN1; SMN2KMT2A
Trifluoroacetic Acid SCHEMBL6162050 0.93 PDE3B (0.34) PDE3BPDE3ATSHRSMN1; SMN2KMT2A
Trifluoroacetic Acid SCHEMBL6167885 0.93 SMN1; SMN2 (0.34) PDE3BPDE3ASMN1; SMN2KMT2AALDH1A1
Trifluoroacetic Acid SCHEMBL6167880 0.93 SMN1; SMN2 (0.34) PDE3BPDE3ASMN1; SMN2KMT2AALDH1A1
Trifluoroacetic Acid SCHEMBL7100570 0.93 CCR8 (0.39) PDE3BPDE3ATSHRKMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof LG CHEM INVESTMENT LTD. (KR) 2003-04-03 US claimed
EP-1254136-A4 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD (KR) 2005-06-01 EP disclosed
US-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof LG CHEM INVESTMENT LTD. (KR) 2003-04-03 US disclosed
EP-1254136-A1 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG Chem Investment, Ltd. (KR) 2002-11-06 EP disclosed
WO-2001055146-A1 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD. (KR) 2001-08-02 WO 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-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof F2, F12, TFPI PDE3B 211/4885PDE3A 172/4885TSHR 1192/4885

“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.