Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8577300

CCCC(=O)OCC1CCCCN1C(=O)O.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.39
DPP8 Q6V1X1 4/20 0.39
FKBP1A P62942 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
HPGD P15428 1/20 0.35
LMNA P02545 1/20 0.35
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NLRP3 Q96P20 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
POLB P06746 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
SCHEMBL28132366 0.82 NAAA (0.48)
SCHEMBL28063604 0.75 CHRNB2 (0.38) NPC1RAB9AHPGDATML3MBTL1
Trifluoroacetic Acid SCHEMBL8917318 0.74 CHRNB2 (0.41) DPP4DPP8LMNAMEN1KMT2A
SCHEMBL20399966 0.72 L3MBTL1 (0.37) NPC1RAB9AHPGDATML3MBTL1
SCHEMBL1421475 0.72 POLB (0.45) DPP4DPP8NPC1RAB9AHPGD
SCHEMBL13731844 0.71 FKBP1A (0.40) FKBP1ANPC1RAB9AHPGDL3MBTL1
SCHEMBL20819833 0.70 NPC1 (0.40) NPC1RAB9AHPGDL3MBTL1MEN1
SCHEMBL22371739 0.70 NPC1 (0.40) NPC1RAB9AHPGDL3MBTL1MEN1
SCHEMBL14645821 0.70 NPC1 (0.40) NPC1RAB9AHPGDL3MBTL1MEN1
SCHEMBL17376785 0.70 NAAA (0.43) ATML3MBTL1MEN1KMT2A

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
US-5763436-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1998-06-09 US disclosed
US-5532232-A INHIBIT THROMBIN INDUCED PLATELET AGGREGATION; FIBRINOGEN ANTICOAGULANTS IN BLOOD HOFFMANN-LA ROCHE INC. (US) 1996-07-02 US disclosed
US-5260307-A Inhibit thrombin-induced platlet aggregation and clotting of fibrogen in plasma HOFMANN-LA ROCHE INC. (US) 1993-11-09 US disclosed