Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5204473

CC(C)n1c(OCCN)nc(OCc2ccc(F)cc2F)c(Br)c1=O.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.40

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
SCHEMBL5233788 0.93 MAPK14 (0.43) MAPK14
SCHEMBL5209259 0.86 MAPK14 (0.46) MAPK14
Trifluoroacetic Acid SCHEMBL5203957 0.85 MAPK14 (0.43) MAPK14
Trifluoroacetic Acid SCHEMBL5209349 0.85 MAPK14 (0.43) MAPK14
SCHEMBL5206024 0.85 MAPK14 (0.46) MAPK14
SCHEMBL5204817 0.84 MAPK14 (0.45) MAPK14
Trifluoroacetic Acid SCHEMBL5202205 0.84 MAPK14 (0.42) MAPK14
SCHEMBL5204251 0.82 MAPK14 (0.41) MAPK14
SCHEMBL5203606 0.80 MAPK14 (0.47) MAPK14
Trifluoroacetic Acid SCHEMBL5238251 0.79 GPR6 (0.40) MAPK14

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
EP-1802590-A1 SUBSTITUTED N-ALKYLPYRIMIDINONES Pharmacia & Upjohn Company LLC (US) 2007-07-04 EP disclosed
WO-2006040666-A1 SUBSTITUTED N-ALKYLPYRIMIDINONES PHARMACIA & UPJOHN COMPANY LLC (US) 2006-04-20 WO disclosed