Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6164863

CC1=C(N)C(=NO)CC=C1[C@H]1C[C@H]1C(=O)Nc1ccc(-c2ccccc2C#N)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ABL1 P00519 1/20 0.34
F10 P00742 1/20 0.34
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
FPR1 P21462 1/20 0.33
FPR2 P25090 1/20 0.33
DEGS1 O15121 1/20 0.33
PTPN5 P54829 1/20 0.32
PTPN1 P18031 1/20 0.32
PRKDC P78527 1/20 0.32
ATM Q13315 1/20 0.32
ATR Q13535 1/20 0.32
HDAC3 O15379 2/20 0.31

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 SCHEMBL6165931 0.89 ABL1 (0.33) ABL1
Trifluoroacetic Acid SCHEMBL6163890 0.89 S1PR1 (0.32) MEN1NPC1MAPTHPGDRAB9A
Trifluoroacetic Acid SCHEMBL6163932 0.86 F10 (0.43) F10
Trifluoroacetic Acid SCHEMBL6163840 0.85 FPR2 (0.39) F10FPR2SCN3A
SCHEMBL6165680 0.80 F10 (0.41) MEN1NPC1MAPTHPGDRAB9A
Trifluoroacetic Acid SCHEMBL6163933 0.80 F10 (0.36) ABL1F10HDAC3NCOR2HDAC1
Trifluoroacetic Acid SCHEMBL7107547 0.76 F10 (0.37) MEN1MAPTKMT2AF10S1PR1
Trifluoroacetic Acid SCHEMBL7106445 0.76 F10 (0.42) MEN1MAPTKMT2AF10S1PR1
Trifluoroacetic Acid SCHEMBL7105827 0.76 F10 (0.42) ABL1F10DEGS1
Trifluoroacetic Acid SCHEMBL6164869 0.75 FPR1 (0.35) MEN1NPC1MAPTHPGDRAB9A

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 MEN1 3229/4885NPC1 2488/4885MAPT 4356/4885

“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.