Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL252559

CC(C)(c1ccc(N)nn1)c1nnc2ccccn12.O=C(O)C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.38
PTGS2 P35354 3/20 0.38
SMN1; SMN2 Q16637 5/20 0.37
RAB9A P51151 5/20 0.37
ALDH1A1 P00352 4/20 0.37
NPC1 O15118 4/20 0.37
HPGD P15428 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 2/20 0.36
KDM4E B2RXH2 3/20 0.35
CYP2C9 P11712 2/20 0.34
CYP1A2 P05177 2/20 0.33
POLB P06746 1/20 0.33
DAPK3 O43293 1/20 0.33
JAK2 O60674 1/20 0.33
PRKD3 O94806 1/20 0.33
MAP4K4 O95819 1/20 0.33
ABL1 P00519 1/20 0.33
CSF1R P07333 1/20 0.33
RET P07949 1/20 0.33

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
SCHEMBL252260 0.89 KDM4E (0.38) SMN1; SMN2RAB9AALDH1A1NPC1HPGD
SCHEMBL252699 0.74 KDM4E (0.40) SMN1; SMN2RAB9AALDH1A1NPC1HPGD
SCHEMBL10224281 0.66 KDM4E (0.50) SMN1; SMN2RAB9AALDH1A1NPC1HPGD
SCHEMBL750920 0.66 KDM4E (0.50) SMN1; SMN2ALDH1A1NPC1HPGDKDM4E
SCHEMBL18912020 0.62 KDM4E (0.49) SMN1; SMN2RAB9AALDH1A1NPC1HPGD
SCHEMBL15979322 0.62 KDM4E (0.49) SMN1; SMN2RAB9AALDH1A1NPC1HPGD
Trifluoroacetic Acid SCHEMBL25420616 0.61 CCR5 (0.41) PTGS1PTGS2SMN1; SMN2RAB9AALDH1A1
Trifluoroacetic Acid SCHEMBL4114425 0.61 JUN (0.39) ALDH1A1LMNAKDM4ECYP1A2POLB
Trifluoroacetic Acid SCHEMBL5132448 0.60 ADORA3 (0.73) PTGS1PTGS2SMN1; SMN2RAB9AALDH1A1
Trifluoroacetic Acid SCHEMBL2083723 0.60 KDM4E (0.49) PTGS1PTGS2SMN1; SMN2RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130315895-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-11-28 US disclosed
EP-2588107-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET Takeda Pharmaceutical Company Limited (JP) 2013-05-08 EP disclosed
US-8178534-B2 cMET inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-05-15 US disclosed
WO-2012003338-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-05 WO disclosed
EP-2313407-A1 cMET INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2011-04-27 EP disclosed
US-20100063054-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-11 US disclosed
WO-2010019899-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 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 (2 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-20130315895-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET HGF, MET, HGFAC PTGS1 4212/4885PTGS2 4391/4885SMN1; SMN2 2559/4885
US-20100063054-A1 cMET INHIBITORS CEPT1, LCAT, GNMT PTGS1 2534/4885PTGS2 2891/4885SMN1; SMN2 4131/4885

“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.