SCHEMBL21641290

SCHEMBL21641290

CC(C)(C)OC(=O)N1CC(C(=O)NOCc2ccccc2)C1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.52
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
NAMPT P43490 1/20 0.46
HTT P42858 1/20 0.45
TACR1 P25103 1/20 0.45
GPR119 Q8TDV5 2/20 0.44
JAK2 O60674 1/20 0.44
JAK1 P23458 1/20 0.44
KDM4E B2RXH2 1/20 0.44
PKM P14618 1/20 0.44
USP30 Q70CQ3 2/20 0.43
RORC P51449 1/20 0.43
YAP1 P46937 1/20 0.42
PTPN2 P17706 1/20 0.42
PTPN1 P18031 1/20 0.42
PTPN6 P29350 1/20 0.42

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
SCHEMBL24392103 0.89 STS (0.65) STSNPC1RAB9ASMN1; SMN2HTT
SCHEMBL29588987 0.85 STS (0.47) STSNPC1RAB9ASMN1; SMN2HTT
SCHEMBL24392548 0.83 NAMPT (0.50) STSNPC1RAB9ANAMPTTACR1
SCHEMBL4921942 0.82 TACR1 (0.56) STSSMN1; SMN2NAMPTHTTTACR1
SCHEMBL24392570 0.81 NAMPT (0.48) STSNAMPTTACR1GPR119JAK2
SCHEMBL17874004 0.81 HPGD (0.54) STSNPC1RAB9ASMN1; SMN2NAMPT
SCHEMBL26470310 0.81 NAMPT (0.58) STSSMN1; SMN2NAMPTTACR1GPR119
SCHEMBL22115170 0.80 STS (0.51) STSSMN1; SMN2NAMPTHTTTACR1
SCHEMBL3328561 0.79 STS (0.81) STSNAMPTTACR1GPR119JAK2
SCHEMBL3546930 0.79 MEN1 (0.50) STSNPC1RAB9ASMN1; SMN2HTT

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 STS 4309/4885NPC1 4631/4885RAB9A 103/4885
US-11286255-B2 Pyridone carboxylic acid derivative or salt thereof RARA, RAB10, RABL6 STS 4106/4885NPC1 4687/4885RAB9A 88/4885

“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.