Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2807127

NC(=O)c1ccc(Nc2ccc(Br)cc2C(F)(F)F)cn1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 8/20 0.49
KIT P10721 6/20 0.49
KMT2A Q03164 1/20 0.42
MPO P05164 1/20 0.38
MAPK8 P45983 1/20 0.38
MAPK10 P53779 1/20 0.38
PTK2 Q05397 3/20 0.38
TAS2R14 Q9NYV8 1/20 0.37
VNN1 O95497 1/20 0.36
KDR P35968 2/20 0.35
CDC7 O00311 1/20 0.35
ROCK2 O75116 1/20 0.35
MAP4K4 O95819 1/20 0.35
PIM1 P11309 1/20 0.35
PRKACA P17612 1/20 0.35
CDK7 P50613 1/20 0.35
CDK9 P50750 1/20 0.35
HIPK2 Q9H2X6 1/20 0.35
IRAK4 Q9NWZ3 1/20 0.35
CNR2 P34972 1/20 0.35

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 SCHEMBL185821 1.00 FLT3 (0.49) FLT3KITKMT2AMPOMAPK8
Trifluoroacetic Acid SCHEMBL185939 0.87 FLT3 (0.49) FLT3KITKMT2AMPOMAPK10
Trifluoroacetic Acid SCHEMBL2807624 0.86 MPO (0.38) FLT3KITMPOMAPK8MAPK10
SCHEMBL184967 0.84 KIT (0.42) FLT3KITKMT2AMPOTAS2R14
SCHEMBL185950 0.83 FLT3 (0.55) FLT3KITKMT2AMAPK8MAPK10
Hydrochloric Acid SCHEMBL2805862 0.82 FLT3 (0.54) FLT3KITKMT2AMAPK8MAPK10
Trifluoroacetic Acid SCHEMBL185819 0.82 MPO (0.36) FLT3KITMPOMAPK8MAPK10
SCHEMBL2804906 0.81 FLT3 (0.53) FLT3KITKMT2AMAPK10PTK2
SCHEMBL2780905 0.78 FLT3 (0.57) FLT3KITKMT2AMAPK8MAPK10
Trifluoroacetic Acid SCHEMBL2813582 0.78 CNR2 (0.39) KMT2AMPOPTK2TAS2R14KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130131075-A1 NEW COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-05-23 US disclosed
US-20100240669-A1 NEW COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-23 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 (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-20130131075-A1 NEW COMPOUNDS ADORA1, H1-10, P2RY11 FLT3 632/4885KIT 989/4885KMT2A 4682/4885
US-20100240669-A1 NEW COMPOUNDS ADORA1, H1-10, P2RY11 FLT3 632/4885KIT 989/4885KMT2A 4682/4885

“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.