Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7423939

NN=Cc1cccc(CN2CCCC(N)C2=O)c1.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 4/20 0.36
DDR1 Q08345 1/20 0.36
KMT2A Q03164 1/20 0.35
NPY1R P25929 1/20 0.35
F10 P00742 3/20 0.35
F2 P00734 6/20 0.34
PRSS1 P07477 6/20 0.34
HRH2 P25021 2/20 0.34
PREP P48147 1/20 0.33

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 SCHEMBL7421816 0.97 NPY1R (0.38) OPRD1DDR1KMT2ANPY1RF10
Trifluoroacetic Acid SCHEMBL7421271 0.94 F10 (0.35) OPRD1KMT2AF10F2PRSS1
Trifluoroacetic Acid SCHEMBL8834439 0.94 F10 (0.35) OPRD1KMT2AF10F2PRSS1
Trifluoroacetic Acid SCHEMBL2329902 0.94 F10 (0.35) OPRD1KMT2AF10F2PRSS1
Trifluoroacetic Acid SCHEMBL7422047 0.88 HDAC3 (0.34) KMT2AF10F2PRSS1HRH2
Trifluoroacetic Acid SCHEMBL7423282 0.84 HRH2 (0.35) KMT2AF10F2PRSS1HRH2
SCHEMBL6049829 0.84 MAPT (0.36) KMT2AF10F2
Trifluoroacetic Acid SCHEMBL7424778 0.81 SLC2A1 (0.36)
Trifluoroacetic Acid SCHEMBL2330275 0.80 GPR6 (0.47)
Trifluoroacetic Acid SCHEMBL7423834 0.80 ALDH1A1 (0.37) KMT2A

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
EP-0853618-A4 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE POULENC RORER PHARMA (US) 2000-03-15 EP claimed
EP-0853618-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-07-22 EP claimed
US-5612353-A ANTICOAGULANT RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-03-18 US claimed
WO-1996040679-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N-[(AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-12-19 WO claimed
EP-0853618-A4 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE POULENC RORER PHARMA (US) 2000-03-15 EP disclosed
EP-0853618-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-07-22 EP disclosed
US-5612353-A ANTICOAGULANT RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-03-18 US disclosed
WO-1996040679-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N-[(AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-12-19 WO disclosed