Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3908408

N=C(N)c1cccc(OC[C@H](N)Cc2ccc(OC3CCNCC3)cc2)c1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.47
F2 P00734 7/20 0.47
PRSS1 P07477 1/20 0.40
HRH1 P35367 2/20 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
Trifluoroacetic Acid SCHEMBL3906991 1.00 F10 (0.47) F10F2PRSS1HRH1
SCHEMBL14132228 0.93 F10 (0.47) F10F2PRSS1HRH1
SCHEMBL14132284 0.93 F10 (0.47) F10F2PRSS1HRH1
Trifluoroacetic Acid SCHEMBL3895701 0.85 F10 (0.43) F10F2
Trifluoroacetic Acid SCHEMBL3912132 0.85 F10 (0.43) F10F2
Trifluoroacetic Acid SCHEMBL3900322 0.84 F2 (0.46) F10F2
Trifluoroacetic Acid SCHEMBL3900418 0.84 F2 (0.46) F10F2
Trifluoroacetic Acid SCHEMBL3900239 0.83 F10 (0.50) F10F2PRSS1
Trifluoroacetic Acid SCHEMBL3907508 0.83 F10 (0.50) F10F2PRSS1
Trifluoroacetic Acid SCHEMBL3896028 0.83 F10 (0.68) F10F2PRSS1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0976722-B1 BENZAMIDINE DERIVATIVES AJINOMOTO KK (JP) 2009-03-11 EP disclosed
US-7396844-B1 Benzamidine derivatives AJINOMOTO CO., INC. (JP) 2008-07-08 US disclosed
EP-0976722-A1 BENZAMIDINE DERIVATIVES Ajinomoto Co., Inc. (JP) 2000-02-02 EP disclosed