SCHEMBL7253264

SCHEMBL7253264

Cc1csc(C(=O)C(F)(F)F)c1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.59
HDAC6 Q9UBN7 15/20 0.54
HDAC4 P56524 10/20 0.43
HDAC1 Q13547 8/20 0.41
HDAC3 O15379 3/20 0.41
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36

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
SCHEMBL13246741 0.82 DAO (0.61) DAOHDAC6CASP3SENP8SENP7
SCHEMBL8111560 0.80 DAO (0.59) DAOHDAC6CASP3SENP8SENP7
SCHEMBL8176992 0.80 DAO (0.59) DAOHDAC6HDAC1HDAC3CASP3
SCHEMBL2224044 0.78 CES1 (0.59) DAOHDAC6HDAC4HDAC1HDAC3
SCHEMBL5859674 0.76 DAO (0.71) DAOCASP3SENP8SENP7SENP6
SCHEMBL7368425 0.76 DAO (0.71) DAOCASP3SENP8SENP7SENP6
SCHEMBL18830929 0.76 HDAC6 (0.54) DAOHDAC6HDAC4HDAC1HDAC3
SCHEMBL58565 0.76 DAO (0.53) DAOHDAC6HDAC4CASP3SENP8
SCHEMBL5313265 0.75 DAO (0.49) DAOHDAC6HDAC4HDAC1HDAC3
SCHEMBL7514096 0.74 DAO (0.52) DAOHDAC6CASP3SENP8SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111354977-A Lithium ion battery electrolyte, preparation method thereof and lithium battery comprising lithium ion battery electrolyte 合肥方耐特能源科技有限公司 2020-06-30 CN disclosed
US-7799825-B2 Thiophene and thiazole substituted trifluoroethanone derivatives as histone deacetylase (HDAC) inhibitors ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2010-09-21 US disclosed
US-20090076101-A1 Thiophene and Thiazole Substituted Trifluoroethanone Derivatives as Histone Deacetylase (HDAC) Inhibitors MSD ITALIA S.R.L. (IT) 2009-03-19 US disclosed
US-6512020-B1 Photosensitive acid-donors in chemically amplified resist formulations. activated by irradiation with actinic electromagnetic radiation and electron beams. CIBA SPECIALTY CHEMICALS CORPORATION 2003-01-28 US disclosed
US-6261738-B1 LATENT CURING CATALYSTS FOR PHOTORESISTS SUCH AS 2,2,2-TRIFLUORO-1-PHENYL-ETHANONE OXIME-O-METHYL SULFONATE CIBA SPECIALTY CHEMICALS CORPORATION 2001-07-17 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-20090076101-A1 Thiophene and Thiazole Substituted Trifluoroethanone Derivatives as Histone Deacetylase (HDAC) Inhibitors HDAC1, HDAC4, HDAC7 DAO 3175/4885HDAC6 10/4885HDAC4 2/4885

“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.