Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6639265

N=C(N)c1ccc(O)c(/C=C/CNC(=O)c2ccc(-c3cccnc3)cc2)c1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.73
PRSS1 P07477 12/20 0.66
F2 P00734 4/20 0.66
PLAT P00750 1/20 0.63
F7 P08709 1/20 0.42
F3 P13726 1/20 0.42
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
PLG P00747 1/20 0.40
PROC P04070 1/20 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
SCHEMBL6639216 0.94 F10 (0.79) F10PRSS1F2PLATDRD2
Trifluoroacetic Acid SCHEMBL6643271 0.90 F10 (0.73) F10PRSS1F2PLATF7
Trifluoroacetic Acid SCHEMBL6639055 0.84 F10 (0.64) F10PRSS1F2PLATMKNK1
Trifluoroacetic Acid SCHEMBL6641817 0.84 F10 (0.88) F10PRSS1F2PLAT
Trifluoroacetic Acid SCHEMBL7900413 0.83 F10 (0.71) F10PRSS1F2PLAT
Trifluoroacetic Acid SCHEMBL6665216 0.82 F10 (0.88) F10PRSS1F2PLATDRD2
Trifluoroacetic Acid SCHEMBL7897445 0.82 F10 (0.68) F10PRSS1F2PLATPLG
Trifluoroacetic Acid SCHEMBL6637824 0.82 F10 (0.88) F10PRSS1F2PLAT
Trifluoroacetic Acid SCHEMBL6644490 0.81 F10 (0.67) F10PRSS1F2PLATPLG
SCHEMBL14509370 0.80 F10 (0.87) F10PRSS1F2PLATPLG

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-0931060-A4 SUBSTITUTED N- (AMINOIMINOMETHYL OR AMINOMETHYL)PHENYL]PROPYL AMIDES AVENTIS PHARMA INC (US) 2004-10-06 EP claimed
US-6323227-B1 PRODRUGS AVENTIS PHARMACEUTICALS PRODUCTS INC. 2001-11-27 US claimed
EP-0931060-A1 SUBSTITUTED N- (AMINOIMINOMETHYL OR AMINOMETHYL)PHENYL]PROPYL AMIDES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-07-28 EP claimed
WO-1999000356-A1 SUBSTITUTED N-[(AMINOIMINOMETHYL OR AMINOMETHYL)PHENYL]PROPYL AMIDES RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1999-01-07 WO claimed
EP-0931060-A4 SUBSTITUTED N- (AMINOIMINOMETHYL OR AMINOMETHYL)PHENYL]PROPYL AMIDES AVENTIS PHARMA INC (US) 2004-10-06 EP disclosed
US-6323227-B1 PRODRUGS AVENTIS PHARMACEUTICALS PRODUCTS INC. 2001-11-27 US disclosed
EP-0931060-A1 SUBSTITUTED N- (AMINOIMINOMETHYL OR AMINOMETHYL)PHENYL]PROPYL AMIDES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-07-28 EP disclosed
WO-1999000356-A1 SUBSTITUTED N-[(AMINOIMINOMETHYL OR AMINOMETHYL)PHENYL]PROPYL AMIDES RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1999-01-07 WO disclosed