SCHEMBL21641259

SCHEMBL21641259

CC(C)(C)OC(=O)N1CC(C(=O)Nc2cc(N)n[nH]2)C1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 1/20 0.43
PTPN1 P18031 1/20 0.43
PTPN6 P29350 1/20 0.43
HDAC1 Q13547 2/20 0.41
HDAC2 Q92769 2/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ABL1 P00519 1/20 0.40
RIN1 Q13671 1/20 0.40
KDM5A P29375 1/20 0.39
STS P08842 2/20 0.39
BUB1 O43683 1/20 0.39
NTRK1 P04629 1/20 0.38
JAK1 P23458 2/20 0.38
PARP1 P09874 1/20 0.37
PARP2 Q9UGN5 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
SCHEMBL15890058 0.77 HTT (0.48) HDAC1HDAC2
SCHEMBL15890029 0.76 HTT (0.45) HDAC1HDAC2KDM5AJAK1
SCHEMBL17388051 0.76 HTT (0.45) HDAC1HDAC2KDM5AJAK1
SCHEMBL17388050 0.76 HTT (0.45) HDAC1HDAC2KDM5AJAK1
SCHEMBL4699047 0.76 MAP4K4 (0.39)
SCHEMBL4045594 0.74 PTPN2 (0.44) PTPN2PTPN1PTPN6HDAC1HDAC2
SCHEMBL2595484 0.74 HDAC2 (0.55) PTPN2PTPN1PTPN6HDAC1HDAC2
SCHEMBL15272178 0.73 PTPN2 (0.55) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL30585823 0.73 PTPN2 (0.46) PTPN2PTPN1PTPN6HDAC1HDAC2
SCHEMBL21639881 0.73 PTPN2 (0.46) PTPN2PTPN1PTPN6HDAC1HDAC2

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
EP-3604305-B1 NOVEL PYRIDONE CARBOXYLIC ACID DERIVATIVE OR SALT THEREOF WAKUNAGA PHARMA CO LTD (JP) 2024-08-28 EP disclosed
CN-110520422-B Novel pyridonecarboxylic acid derivative or salt thereof 涌永制药株式会社 2023-09-05 CN disclosed
US-11286255-B2 Pyridone carboxylic acid derivative or salt thereof WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2022-03-29 US disclosed
US-20200062752-A1 NOVEL PYRIDONE CARBOXYLIC ACID DERIVATIVE OR SALT THEREOF WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2020-02-27 US disclosed
EP-3604305-A1 NOVEL PYRIDONE CARBOXYLIC ACID DERIVATIVE OR SALT THEREOF Wakunaga Pharmaceutical Co., Ltd. (JP) 2020-02-05 EP 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 (2 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-20200062752-A1 NOVEL PYRIDONE CARBOXYLIC ACID DERIVATIVE OR SALT THEREOF RAB10, HDAC10, NEK10 PTPN2 427/4885PTPN1 322/4885PTPN6 398/4885
US-11286255-B2 Pyridone carboxylic acid derivative or salt thereof RARA, RAB10, RABL6 PTPN2 321/4885PTPN1 286/4885PTPN6 343/4885

“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.