Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7107547

CC1=C(N)C(=NO)CC=C1c1nc(C)ccc1C(=O)Nc1ccc(-c2ccccc2C#N)cc1.O=C(O)C(F)(F)F.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
F10 P00742 10/20 0.37
PRKDC P78527 1/20 0.37
ATM Q13315 1/20 0.37
ATR Q13535 1/20 0.37
PRSS1 P07477 8/20 0.34
PRSS2 P07478 8/20 0.34
PRSS3 P35030 8/20 0.34
F2 P00734 6/20 0.34
LMNA P02545 2/20 0.33
POLB P06746 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
GRM5 P41594 1/20 0.33
OPRL1 P41146 1/20 0.33
PTPN5 P54829 1/20 0.33
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32

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
SCHEMBL6163134 0.95 F10 (0.38) F10PRKDCATMATRLMNA
Trifluoroacetic Acid SCHEMBL7106445 0.90 F10 (0.42) F10PRKDCATMATRPRSS1
Trifluoroacetic Acid SCHEMBL7104516 0.87 F10 (0.41) F10ATRPRSS1PRSS2PRSS3
SCHEMBL6161703 0.84 TRPV1 (0.41) F10PRKDCATMATRPRSS1
SCHEMBL6166095 0.81 F10 (0.42) F10ATRPRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL7106428 0.80 F10 (0.37) F10PRKDCATMATRPRSS1
Trifluoroacetic Acid SCHEMBL7101266 0.77 F10 (0.51) F10ATRPRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL7108370 0.77 F10 (0.58) F10PRSS1PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL6164863 0.76 MEN1 (0.34) F10PRKDCATMATRS1PR1
Trifluoroacetic Acid SCHEMBL7102295 0.76 F10 (0.49) F10PRSS1PRSS2PRSS3F2

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 1 patent. 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

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 F10 11/4885PRKDC 2333/4885ATM 1651/4885

“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.