SCHEMBL13246741

SCHEMBL13246741

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

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.61
CASP3 P42574 2/20 0.37
SENP7 Q9BQF6 2/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
HDAC6 Q9UBN7 1/20 0.36
KDR P35968 3/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TP53 P04637 1/20 0.34
GSK3B P49841 3/20 0.34
RAF1 P04049 1/20 0.33
GRIN2B Q13224 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
SCHEMBL8111560 0.86 DAO (0.59) DAOCASP3SENP7SENP8SENP6
SCHEMBL8176992 0.86 DAO (0.59) DAOCASP3SENP7SENP8SENP6
SCHEMBL7253264 0.82 DAO (0.59) DAOCASP3SENP7SENP8SENP6
SCHEMBL58565 0.81 DAO (0.53) DAOCASP3SENP7SENP8SENP6
SCHEMBL7514103 0.80 DAO (0.52) DAOCASP3SENP7SENP8SENP6
SCHEMBL7514096 0.80 DAO (0.52) DAOCASP3SENP7SENP8SENP6
SCHEMBL24198721 0.79 CES2 (0.59) DAOHDAC6CES2CES1MAPT
SCHEMBL13246754 0.78 HDAC6 (0.51) DAOHDAC6MAPT
SCHEMBL5859674 0.78 DAO (0.71) DAOCASP3SENP7SENP8SENP6
SCHEMBL7368425 0.78 DAO (0.71) DAOCASP3SENP7SENP8SENP6

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
US-11731967-B2 Inhibitors of TRIM33 and methods of use DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-08-22 US disclosed
US-10207481-B2 Transfer film, method for manufacturing laminate, laminate, electrostatic capacitance-type input device, and image display device FUJIFILM CORPORATION (JP) 2019-02-19 US disclosed
US-20170157899-A1 TRANSFER FILM, METHOD FOR MANUFACTURING LAMINATE, LAMINATE, ELECTROSTATIC CAPACITANCE-TYPE INPUT DEVICE, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2017-06-08 US disclosed
US-20150337013-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS MERCK SHARP & DOHME CORP. (US) 2015-11-26 US disclosed
US-20140073558-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CUBIST PHARMACEUTICALS, INC. (US) 2014-03-13 US disclosed
US-8507647-B2 Antibacterial agents for the treatment of gram positive infections CUBIST PHARMACEUTICALS, INC. (US) 2013-08-13 US disclosed
US-20100184649-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CUBIST PHARMACEUTICALS, INC. 2010-07-22 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 (4 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-11731967-B2 Inhibitors of TRIM33 and methods of use TRIM33, TRIM28, TRIM4 DAO 4312/4885CASP3 1593/4885SENP7 713/4885
US-20150337013-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CLPP, CLPTM1, RPN1 DAO 1026/4885CASP3 457/4885SENP7 2446/4885
US-20100184649-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CLPP, CLPTM1, RPN1 DAO 1026/4885CASP3 457/4885SENP7 2446/4885
US-20140073558-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CLPP, CLPTM1, RPN1 DAO 1026/4885CASP3 457/4885SENP7 2446/4885

“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.