Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL949362

O=C(O)C(F)(F)F.O=C(O)CCNCc1ccc(OCc2ccc(Cl)cc2)cc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.57
LMNA P02545 1/20 0.56
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
NR4A2 P43354 1/20 0.51
FFAR1 O14842 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
PPARA Q07869 1/20 0.47
MAOB P27338 2/20 0.47
MAOA P21397 1/20 0.47

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
SCHEMBL15890891 0.93 BCHE (0.65) BCHELMNANPC1RAB9ANR4A2
Trifluoroacetic Acid SCHEMBL948968 0.90 FFAR1 (0.60) BCHEFFAR1FFAR4
Trifluoroacetic Acid SCHEMBL947309 0.89 BCHE (0.56) BCHENR4A2FFAR1FFAR4
Trifluoroacetic Acid SCHEMBL949821 0.88 SMN1; SMN2 (0.54) BCHENR4A2FFAR1MAOBMAOA
Trifluoroacetic Acid SCHEMBL947962 0.87 S1PR1 (0.59) BCHELMNANR4A2FFAR1FFAR4
Trifluoroacetic Acid SCHEMBL948409 0.84 FFAR1 (0.60) BCHEFFAR1FFAR4
SCHEMBL949364 0.84 LMNA (0.54) BCHELMNANPC1RAB9ANR4A2
SCHEMBL15891108 0.82 BCHE (0.69) BCHEFFAR1FFAR4
Trifluoroacetic Acid SCHEMBL950311 0.81 LTA4H (0.61) LMNAFFAR1
SCHEMBL15890793 0.81 BCHE (0.64) BCHENR4A2FFAR1FFAR4MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2883865-A1 Compound capable of binding S1P receptor and pharmaceutical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2015-06-17 EP disclosed
US-20140288034-A1 COMPOUND CAPABLE OF BINDING S1P RECEPTOR AND PHARMACEUTICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2014-09-25 US disclosed
US-8791159-B2 Compound capable of binding S1P receptor and pharmaceutical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2014-07-29 US disclosed
US-20110020324-A1 COMPOUND CAPABLE OF BINDING S1P RECEPTOR AND PHARMACEUTICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD (JP) 2011-01-27 US disclosed
US-7825109-B2 Compound capable of binding S1P receptor and pharmaceutical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2010-11-02 US disclosed
US-20070167425-A1 Compound capable of binding s1p receptor and pharmaceutical use thereof ONO PHARMACEUTICAL CO., LTD (JP) 2007-07-19 US disclosed
EP-1661881-A2 COMPOUND CAPABLE OF BINDING S1P RECEPTOR AND PHARMACEUTICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-05-31 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140288034-A1 COMPOUND CAPABLE OF BINDING S1P RECEPTOR AND PHARMACEUTICAL USE THEREOF S1PR1, S1PR2, S1PR3 BCHE 2952/4885LMNA 2786/4885NPC1 263/4885
US-20070167425-A1 Compound capable of binding s1p receptor and pharmaceutical use thereof S1PR1, S1PR3, S1PR2 BCHE 3117/4885LMNA 3761/4885NPC1 601/4885
US-20110020324-A1 COMPOUND CAPABLE OF BINDING S1P RECEPTOR AND PHARMACEUTICAL USE THEREOF S1PR1, S1PR3, S1PR2 BCHE 3117/4885LMNA 3761/4885NPC1 601/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.