Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4598196

NCc1ccccc1SCC(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
FFAR4 Q5NUL3 6/20 0.35
FFAR1 O14842 3/20 0.34
CES1 P23141 3/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
DPP4 P27487 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.32
CPA1 P15085 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL8244260 0.89 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3DPP4
Hydrochloric Acid SCHEMBL7367954 0.87 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3DPP4
SCHEMBL7360936 0.75 APOBEC3G (0.55) FFAR4SLC6A2SLC6A4SLC6A3CYP2C19
SCHEMBL16815447 0.75 SMN1; SMN2 (0.41) SMN1; SMN2FFAR4FFAR1CYP2C9CYP2C19
SCHEMBL16815699 0.75 SMN1; SMN2 (0.41) SMN1; SMN2FFAR4FFAR1CYP2C9CYP2C19
SCHEMBL11533963 0.74 CYP1A2 (0.58) KDM4EFFAR1CYP2C9HPGDCYP2C19
SCHEMBL4597973 0.72 CYP1A2 (0.61) SMN1; SMN2CYP2C9CYP1A2
SCHEMBL16815223 0.72 APOBEC3G (0.32) SLC6A2SLC6A4SLC6A3
SCHEMBL4597843 0.71 SIRT1 (0.50) KDM4ESMN1; SMN2CYP2C9HPGDCYP2C19
SCHEMBL27583379 0.71 POLB (0.47) SMN1; SMN2CYP2C9HPGDCYP2C19CYP1A2

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
US-7456195-B2 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-25 US disclosed
EP-1910298-A2 PHENYLGLYCINAMIDE AND PYRIDYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS Brystol-Myers Squibb Company (US) 2008-04-16 EP disclosed
WO-2007002313-A2 PHENYLGLYCINAMIDE AND PYRIDYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 WO disclosed
US-20070003539-A1 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 US 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 (1 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-20070003539-A1 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants F12, F11, F7 KDM4E 1847/4885SMN1; SMN2 4597/4885FFAR4 2129/4885

“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.