Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3529466

FC(F)(F)c1cc(Nc2nnc(-c3cccc(Oc4ccncc4)c3)[nH]2)ccc1Cl.O=C(O)C(F)(F)F

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.54
RAF1 P04049 8/20 0.45
BRAF P15056 6/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 1/20 0.45
RET P07949 2/20 0.44
CDK8 P49336 3/20 0.42
FLT1 P17948 2/20 0.41
PLK4 O00444 1/20 0.41
CIT O14578 1/20 0.41
AURKA O14965 1/20 0.41
MUSK O15146 1/20 0.41
EPHB6 O15197 1/20 0.41
MAPK13 O15264 1/20 0.41
MLNR O43193 1/20 0.41
MAP3K7 O43318 1/20 0.41
RIPK2 O43353 1/20 0.41
DYRK3 O43781 1/20 0.41
PDE6D O43924 1/20 0.41

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
SCHEMBL12015907 0.94 KDR (0.60) KDRRAF1BRAFMEN1KMT2A
Trifluoroacetic Acid SCHEMBL3537042 0.90 KDR (0.53) KDRRAF1BRAFMEN1KMT2A
Trifluoroacetic Acid SCHEMBL3533061 0.88 RAF1 (0.63) KDRRAF1BRAFMEN1KMT2A
Trifluoroacetic Acid SCHEMBL3575960 0.86 RAF1 (0.49) KDRRAF1BRAFMEN1KMT2A
Trifluoroacetic Acid SCHEMBL3530517 0.85 CDK8 (0.45) KDRRAF1BRAFMEN1KMT2A
Trifluoroacetic Acid SCHEMBL3529822 0.84 RAF1 (0.47) KDRRAF1BRAFMEN1KMT2A
Trifluoroacetic Acid SCHEMBL3529522 0.84 KDR (0.42) KDRRAF1BRAFMEN1KMT2A
SCHEMBL12015900 0.84 RAF1 (0.66) KDRRAF1BRAFMEN1KMT2A
SCHEMBL12015908 0.83 KDR (0.59) KDRRAF1BRAFMEN1KMT2A
Trifluoroacetic Acid SCHEMBL3533960 0.81 MEN1 (0.44) KDRRAF1BRAFMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130243754-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE TARGEGEN, INC. (US) 2013-09-19 US disclosed
US-8372971-B2 Heterocyclic compounds and methods of use TARGEGEN, INC. (US) 2013-02-12 US disclosed
EP-2532653-A1 Benzo[1,2,4]triazines as protein kinase modulators Targegen, Inc. (US) 2012-12-12 EP disclosed
US-20120220584-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE TARGEGEN, INC. (US) 2012-08-30 US disclosed
US-8084618-B2 Heterocyclic compounds and methods of use TARGEGEN, INC. (US) 2011-12-27 US disclosed
US-20100330069-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE TARGEGEN, INC. (US) 2010-12-30 US disclosed
US-7652051-B2 Heterocyclic compounds and methods of use TARGEGEN, INC. (US) 2010-01-26 US disclosed
US-20060079526-A1 Heterocyclic compounds and methods of use TARGEGEN, INC. (US) 2006-04-13 US 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 (4 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-20120220584-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE AADAC, NISCH, PAICS KDR 4380/4885RAF1 2602/4885BRAF 1296/4885
US-20130243754-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE AADAC, NISCH, PAICS KDR 4380/4885RAF1 2602/4885BRAF 1296/4885
US-20060079526-A1 Heterocyclic compounds and methods of use AADAC, NISCH, PAICS KDR 4380/4885RAF1 2602/4885BRAF 1296/4885
US-20100330069-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE AADAC, NISCH, PAICS KDR 4380/4885RAF1 2602/4885BRAF 1296/4885

“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.