Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6638262

COC(=O)[C@H](Cc1cccc(C(=N)N)c1)[C@@H](C)NC(=O)c1ccc(-c2ccc(OC)c(OC)c2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.76

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.76
PRSS1 P07477 17/20 0.76
F2 P00734 6/20 0.76
PLG P00747 1/20 0.73
TMPRSS2 O15393 1/20 0.68
PRSS2 P07478 1/20 0.68
PRSS3 P35030 1/20 0.68

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 SCHEMBL6638259 1.00 F10 (0.76) F10PRSS1F2PLGTMPRSS2
Trifluoroacetic Acid SCHEMBL6644529 0.87 F10 (0.73) F10PRSS1F2PLGTMPRSS2
Trifluoroacetic Acid SCHEMBL6644526 0.87 F10 (0.73) F10PRSS1F2PLGTMPRSS2
Trifluoroacetic Acid SCHEMBL6641247 0.86 F10 (0.73) F10PRSS1F2PLGTMPRSS2
Trifluoroacetic Acid SCHEMBL7902234 0.86 F10 (0.73) F10PRSS1F2PLGTMPRSS2
Trifluoroacetic Acid SCHEMBL6680558 0.84 F10 (0.89) F10PRSS1F2PLGTMPRSS2
SCHEMBL12386972 0.84 F10 (1.00) F10PRSS1F2PLGTMPRSS2
SCHEMBL12589582 0.83 F10 (1.00) F10PRSS1F2PLGTMPRSS2
SCHEMBL12521569 0.83 F10 (1.00) F10PRSS1F2PLGTMPRSS2
SCHEMBL10072203 0.83 F10 (1.00) F10PRSS1F2PLGTMPRSS2

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 4 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 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