Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5483824

Cc1cnc(NCC2CCNCC2)nc1C(C#N)=C1Nc2ccccc2O1.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
▸ FLT3 P36888 7/20 0.37
▸ HRH4 Q9H3N8 4/20 0.37
▸ HRH3 Q9Y5N1 3/20 0.37
▸ CHEK1 O14757 3/20 0.35
▸ CHRM3 P20309 1/20 0.35
▸ SGK1 O00141 1/20 0.35
▸ ROCK2 O75116 1/20 0.35
▸ RPS6KA5 O75582 1/20 0.35
▸ RAF1 P04049 1/20 0.35
▸ SRC P12931 1/20 0.35
▸ CCNA2 P20248 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ MAPK8 P45983 1/20 0.35
▸ MAPK9 P45984 1/20 0.35
▸ BLK P51451 1/20 0.35
▸ RPS6KA3 P51812 1/20 0.35
▸ MAP2K6 P52564 1/20 0.35
▸ MAPK10 P53779 1/20 0.35
▸ CCNA1 P78396 1/20 0.35
▸ MAPK14 Q16539 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 SCHEMBL5483819 1.00 FLT3 (0.37) FLT3HRH4HRH3CHEK1CHRM3
SCHEMBL5479125 0.94 KHK (0.37) FLT3HRH4CHEK1CCNA2CDK2
SCHEMBL5479121 0.94 KHK (0.37) FLT3HRH4CHEK1CCNA2CDK2
Trifluoroacetic Acid SCHEMBL5481009 0.86 SGK1 (0.45) FLT3HRH4HRH3CHEK1CHRM3
Trifluoroacetic Acid SCHEMBL5481008 0.86 SGK1 (0.45) FLT3HRH4HRH3CHEK1CHRM3
SCHEMBL5483836 0.85 CYP11B2 (0.40) FLT3TYRO3MERTKGAS6
SCHEMBL5483833 0.85 CYP11B2 (0.40) FLT3TYRO3MERTKGAS6
SCHEMBL8294128 0.85 CYP11B2 (0.40) FLT3TYRO3MERTKGAS6
SCHEMBL8292579 0.83 GRIN2B (0.38) KHK
SCHEMBL14431020 0.82 GRIN2B (0.41) CCNA2CDK2MERTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185104-A1 Benzoxazole acetonitriles APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2007-08-09 — — US disclosed
EP-1668004-A1 BENZOXAZOLE ACETONITRILES Applied Research Systems ARS Holding N.V. (AN) 2006-06-14 — — EP disclosed
WO-2005026159-A1 BENZOXAZOLE ACETONITRILES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2005-03-24 — — 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-20070185104-A1 Benzoxazole acetonitriles PKD1, PC, GPR119 FLT3 1567/4885HRH4 1758/4885HRH3 1293/4885

“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.

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