SCHEMBL25272136

SCHEMBL25272136

CC(CNC(=O)OC(C)(C)C)n1nc(-c2ccc(F)cc2)cc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 4/20 0.46
PHGDH O43175 7/20 0.41
SCN9A Q15858 3/20 0.39
HDAC3 O15379 2/20 0.39
HDAC4 P56524 2/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC7 Q8WUI4 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC10 Q969S8 2/20 0.39
HDAC11 Q96DB2 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
HDAC9 Q9UKV0 2/20 0.39
HDAC5 Q9UQL6 2/20 0.39
GRM2 Q14416 1/20 0.38
BRD9 Q9H8M2 1/20 0.38
F2RL1 P55085 1/20 0.38
MKNK2 Q9HBH9 1/20 0.37
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37

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
SCHEMBL25272135 1.00 HDAC6 (0.46) HDAC6PHGDHSCN9AHDAC3HDAC4
SCHEMBL28875917 0.88 HDAC6 (0.43) HDAC6PHGDHSCN9AHDAC3HDAC4
SCHEMBL28875921 0.88 HDAC6 (0.43) HDAC6PHGDHSCN9AHDAC3HDAC4
SCHEMBL25428181 0.80 PCSK9 (0.38) MKNK2CTSSCTSK
SCHEMBL25428186 0.80 PCSK9 (0.38) MKNK2CTSSCTSK
SCHEMBL30519641 0.79 AAK1 (0.39) MKNK2CTSSCTSK
SCHEMBL26025544 0.78 SERPINE1 (0.37) BRD9MKNK2
SCHEMBL17334271 0.76 SYK (0.41) HDAC1
SCHEMBL17334270 0.76 SYK (0.41) HDAC1
SCHEMBL25436831 0.70 AAK1 (0.39) CTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192699-A1 COMPOUNDS AS CASEIN KINASE INHIBITORS Gritscience Biopharmaceuticals Co., Ltd. (CN) 2023-06-22 US disclosed
CN-115335057-A Method for inhibiting casein kinase 北京原基华毅生物科技有限公司 2022-11-11 CN disclosed
CN-115298183-A Compounds as casein kinase inhibitors 北京原基华毅生物科技有限公司 2022-11-04 CN 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-20230192699-A1 COMPOUNDS AS CASEIN KINASE INHIBITORS CSNK2A3, CSNK1A1, CSNK1G3 HDAC6 839/4885PHGDH 2092/4885SCN9A 780/4885

“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.