Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8424682

COc1ccc2ccc(S(=O)(=O)NNC(C)=O)cc2c1.O=C(O)C(F)(F)F

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 5/20 0.53
RAPGEF3 O95398 1/20 0.50
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
PLAU P00749 4/20 0.46
GFER P55789 1/20 0.45
BCAT1 P54687 3/20 0.45
KMT2A Q03164 1/20 0.44
PLAT P00750 1/20 0.43
PTPRC P08575 1/20 0.43
PTPN11 Q06124 1/20 0.43
PTPN13 Q12923 1/20 0.43
PTPN22 Q9Y2R2 1/20 0.43

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
SCHEMBL8428170 0.92 KAT6A (0.60) KAT6ARAPGEF3ALDH1A1MAPTPLAU
Trifluoroacetic Acid SCHEMBL8424679 0.80 RAPGEF3 (0.51) KAT6ARAPGEF3ALDH1A1MAPTPLAU
Acetamide SCHEMBL8424678 0.76 RAPGEF3 (0.49) KAT6ARAPGEF3PLAUKMT2APLAT
SCHEMBL8425827 0.74 RAPGEF3 (0.57) KAT6ARAPGEF3ALDH1A1MAPTPLAU
SCHEMBL8425825 0.73 MAPT (0.60) KAT6ARAPGEF3ALDH1A1MAPTPLAU
SCHEMBL2330600 0.71 MEN1 (0.50) RAPGEF3ALDH1A1PLAUKMT2APLAT
SCHEMBL8428166 0.69 RAPGEF3 (0.58) KAT6ARAPGEF3ALDH1A1PLAUKMT2A
SCHEMBL2326546 0.69 MEN1 (0.58) RAPGEF3PLAUKMT2A
SCHEMBL8428222 0.68 RAPGEF3 (0.54) KAT6ARAPGEF3ALDH1A1MAPTPLAU
Hydrochloric Acid SCHEMBL27504393 0.68 MEN1 (0.56) RAPGEF3PLAUKMT2A

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-5958918-A Substituted (sulfinic acid, sulfonic acid, sulfonylamino or sulfinylamino) N- (aminominomethyl)phenylalkyl!-azaheterocyclylamide compounds RHONE-POULENC RORER PHARMACEUTICALS INC. 1999-09-28 US claimed
US-5958918-A Substituted (sulfinic acid, sulfonic acid, sulfonylamino or sulfinylamino) N- (aminominomethyl)phenylalkyl!-azaheterocyclylamide compounds RHONE-POULENC RORER PHARMACEUTICALS INC. 1999-09-28 US disclosed