Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2045650

CC(C)[C@H](NC(=O)[C@H](C)N)C(=O)N1CCC[C@H]1C(=O)c1nc2ccccc2s1.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
XIAP P98170 2/20 0.49
ELANE P08246 10/20 0.46
CCR1 P32246 1/20 0.44
KMT2A Q03164 1/20 0.43
CTSG P08311 1/20 0.42
F2 P00734 1/20 0.41
MLX Q9UH92 1/20 0.41
PRSS1 P07477 2/20 0.41
TPSAB1 Q15661 2/20 0.41
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
CASP1 P29466 1/20 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 SCHEMBL1717284 0.85 F2 (0.42) F2PRSS1TPSAB1ALOX15TSHR
SCHEMBL4412440 0.82 CMA1 (0.46) ELANECCR1KMT2AALOX15TSHR
Trifluoroacetic Acid SCHEMBL1509589 0.81 XIAP (0.53) XIAPELANEKMT2ACTSGMLX
Trifluoroacetic Acid SCHEMBL1718165 0.81 XIAP (0.47) XIAPELANECTSGMLX
Trifluoroacetic Acid SCHEMBL27641390 0.81 XIAP (0.53) XIAPELANEKMT2ACTSGMLX
SCHEMBL5965048 0.78 FAP (0.43) F2ALOX15TSHRCASP1
SCHEMBL7279628 0.75 ELANE (0.50) ELANECCR1KMT2AF2ALOX15
SCHEMBL8344533 0.74 MAOB (0.49) KMT2AALOX15TSHRCASP1
SCHEMBL8263228 0.74 ACE (0.55) KMT2AF2PRSS1
SCHEMBL2769300 0.74 XIAP (0.44) XIAPELANEKMT2AMLXTSHR

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1434792-A2 PEPTIDYL KETONES AS INHIBITORS OF DPIV Probiodrug AG (DE) 2004-07-07 EP claimed
US-20030148961-A1 Peptidyl ketones as inhibitors of DPIV PROSIDION LIMITED (GB) 2003-08-07 US claimed
WO-2003033524-A2 PEPTIDYL KETONES AS INHIBITORS OF DPIV PROBIODRUG AG (DE) 2003-04-24 WO claimed
EP-2338490-A2 Combinations Useful for the Treatment of Neuronal Disorders Probiodrug AG (DE) 2011-06-29 EP disclosed
US-7897633-B2 Neuronal disorders such as Alzheimer's disease, Down Syndrome, Parkinson disease, Chorea Huntington, pathogenic psychotic conditions, schizophrenia, impaired food intake, sleep-wakefulness, impaired homeostatic regulation of energy metabolism, impaired autonomic function; alcoholism PROBIODRUG AG (DE) 2011-03-01 US disclosed
US-7816325-B2 Secondary binding site of dipeptidyl peptidase IV (DP IV) OSI PHARMACEUTICALS, INC. (US) 2010-10-19 US disclosed
US-20100159032-A1 COMBINATIONS USEFUL FOR THE TREATMENT OF NEURONAL DISORDERS PROBIODRUG AG (DE) 2010-06-24 US disclosed
EP-1620091-B1 INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2010-03-31 EP disclosed
EP-1543023-B1 SECONDARY BINDING SITE OF DIPEPTIDYL PEPTIDASE IV (DP IV) PROSIDION LTD (GB) 2010-03-17 EP disclosed
US-7655684-B2 1-(Urea-, thiourea- and cyanoguanidine-methylene)benzyl)imidaoles, treatment of neuronal disorders, especially Alzheimer's disease, Down Syndrome, Parkinson's disease and Huntington's disease PROBIODRUG AG (DE) 2010-02-02 US disclosed
US-7608577-B2 Peptidyl ketones as inhibitors of DPIV OSI PHARMACEUTICALS, INC. (US) 2009-10-27 US disclosed
WO-2005075436-A2 NOVEL INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2005-08-18 WO disclosed
US-20050176622-A1 Secondary binding site of dipeptidyl peptidase IV (DPIV) PROSIDION LIMITED (GB) 2005-08-11 US disclosed
US-20050171112-A1 Combinations useful for the treatment of neuronal disorders PROBIODRUG AG 2005-08-04 US disclosed
US-20050137142-A1 Combinations useful for the treatment of neuronal disorders PROBIODRUG AG 2005-06-23 US disclosed
EP-1543023-A2 SECONDARY BINDING SITE OF DIPEPTIDYL PEPTIDASE IV (DP IV) Prosidion Limited (GB) 2005-06-22 EP disclosed
WO-2005049027-A2 COMBINATIONS USEFUL FOR THE TREATMENT OF NEURONAL DISORDERS PROBIODRUG AG (DE) 2005-06-02 WO disclosed
WO-2004098591-A2 INHIBITORS OF GLUTAMINYL CYCLASE AND THEIR USE IN THE TREATMENT OF NEUROLOGICAL DISEASES PROBIODRUG AG (DE) 2004-11-18 WO disclosed
US-20040224875-A1 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2004-11-11 US disclosed
WO-2004031374-A2 SECONDARY BINDING SITE OF DIPEPTIDYL PEPTIDASE IV (DP IV) PROSIDION LTD. (GB) 2004-04-15 WO 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 (6 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-20050171112-A1 Combinations useful for the treatment of neuronal disorders MME, DNPEP, DPP4 XIAP 717/4885ELANE 619/4885CCR1 4508/4885
US-20030148961-A1 Peptidyl ketones as inhibitors of DPIV GLS, SLC5A1, BCKDK XIAP 1058/4885ELANE 1996/4885CCR1 2144/4885
US-20050176622-A1 Secondary binding site of dipeptidyl peptidase IV (DPIV) DPP4, DPP3, DPP7 XIAP 320/4885ELANE 2420/4885CCR1 2308/4885
US-20040224875-A1 Inhibitors of glutaminyl cyclase GLS2, GLS, GLUL XIAP 3488/4885ELANE 4498/4885CCR1 4732/4885
US-20100159032-A1 COMBINATIONS USEFUL FOR THE TREATMENT OF NEURONAL DISORDERS MME, DNPEP, DPP4 XIAP 717/4885ELANE 619/4885CCR1 4508/4885
US-20050137142-A1 Combinations useful for the treatment of neuronal disorders MME, DNPEP, DPP4 XIAP 1827/4885ELANE 621/4885CCR1 4353/4885

“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.