SCHEMBL357042

SCHEMBL357042

C[C@H]1CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.46
NPC1 O15118 1/20 0.46
HPGD P15428 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
EPHX1 P07099 1/20 0.43
UCHL1 P09936 1/20 0.42
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 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
SCHEMBL178721 1.00 HSD17B10 (0.52) HSD17B10SMN1; SMN2NPC1HPGDALDH1A1
SCHEMBL357043 1.00 HSD17B10 (0.52) HSD17B10SMN1; SMN2NPC1HPGDALDH1A1
SCHEMBL1202111 0.95 HPGD (0.49) HSD17B10SMN1; SMN2NPC1HPGDALDH1A1
SCHEMBL7005690 0.95 HPGD (0.49) HSD17B10SMN1; SMN2NPC1HPGDALDH1A1
SCHEMBL7002987 0.95 HPGD (0.49) HSD17B10SMN1; SMN2NPC1HPGDALDH1A1
SCHEMBL28508217 0.89 HSD17B10 (0.50) HSD17B10SMN1; SMN2NPC1HPGDALDH1A1
SCHEMBL4175218 0.89 CHRM2 (0.44) HSD17B10SMN1; SMN2HPGDEPHX1CHRM2
SCHEMBL489128 0.89 CHRM2 (0.44) HSD17B10SMN1; SMN2HPGDEPHX1CHRM2
SCHEMBL489126 0.89 CHRM2 (0.44) HSD17B10SMN1; SMN2HPGDEPHX1CHRM2
SCHEMBL18161917 0.88 HSD17B10 (0.49) HSD17B10SMN1; SMN2NPC1HPGDALDH1A1

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 110 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150291623-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2015-10-15 US claimed
US-20120295897-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2012-11-22 US claimed
US-12043640-B2 Prodrugs of STAT3 inhibitors TVARDI THERAPEUTICS, INC. (US) 2024-07-23 US disclosed
CN-117343064-B Preparation and application of pyrimidine derivative with antiviral effect 南京知和医药科技有限公司 2024-04-16 CN disclosed
US-20240018172-A1 PRODRUGS OF STAT3 INHIBITORS TVARDI OPERATING COMPANY, INC. 2024-01-18 US disclosed
CN-117343064-A Preparation and application of pyrimidine derivative with antiviral effect 南京知和医药科技有限公司 2024-01-05 CN disclosed
US-20230364070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ANTARES THERAPEUTICS, INC. 2023-11-16 US disclosed
CN-116368136-A EGFR inhibitors 大鹏药品工业株式会社 2023-06-30 CN disclosed
US-20230183188-A1 ENPP1 MODULATORS AND USES THEREOF Vir Biotechnology, Inc. 2023-06-15 US disclosed
WO-2023081840-A1 KRAS G12C INHIBITORS FRONTIER MEDICINES CORPORATION (US) 2023-05-11 WO disclosed
WO-2023070064-A1 O-GLCNACASE (OGA) INHIBITOR COMBINATION THERAPY ELI LILLY AND COMPANY (US) 2023-04-27 WO disclosed
WO-2005106011-A2 PROCESS FOR PREPARING DIPEPTIDYL IV INHIBITORS AND INTERMEDIATES THEREFOR BRISTOL-MYERS SQUIBB COMPANY (US) 2005-11-10 WO disclosed
CN-1688527-A Fused benzene derivatives and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2005-10-26 CN disclosed
EP-1562897-A1 PHENYLCARBOXAMIDE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER S DISEASE Merck & Co., Inc. (US) 2005-08-17 EP disclosed
US-20040260100-A1 Process for preparing 2-methylpyrrolidine and specific enantiomers thereof ABBVIE INC. 2004-12-23 US disclosed
WO-2004076388-A2 PROCESS FOR PREPARING 2-METHYLPYRROLIDINE AND SPECIFIC ENANTIOMERS THEREOF ABBOTT LABORATORIES (US) 2004-09-10 WO disclosed
US-20040171845-A1 Process for preparing 2-methylpyrrolidine and specific enantiomers thereof ABBOTT LABORATORIES 2004-09-02 US disclosed
WO-2004043916-A1 PHENYLCARBOXAMIDE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE MERCK & CO., INC. (US) 2004-05-27 WO disclosed
EP-0771319-A1 TRICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-05-07 EP disclosed
WO-1996002542-A1 TRICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-01 WO 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 (8 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-20040171845-A1 Process for preparing 2-methylpyrrolidine and specific enantiomers thereof QDPR, PNMT, MTAP HSD17B10 3285/4885SMN1; SMN2 876/4885NPC1 4510/4885
US-12043640-B2 Prodrugs of STAT3 inhibitors STAT3, JAK2, STAT6 HSD17B10 1926/4885SMN1; SMN2 3949/4885NPC1 1244/4885
US-20240018172-A1 PRODRUGS OF STAT3 INHIBITORS STAT3, JAK2, STAT1 HSD17B10 1935/4885SMN1; SMN2 3972/4885NPC1 1245/4885
US-20040260100-A1 Process for preparing 2-methylpyrrolidine and specific enantiomers thereof QDPR, PNMT, MTAP HSD17B10 3285/4885SMN1; SMN2 876/4885NPC1 4510/4885
US-20150291623-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS TRPV3, TRPV1, TRPC3 HSD17B10 2243/4885SMN1; SMN2 289/4885NPC1 790/4885
US-20230364070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ERBB2, EGFR, ERBB3 HSD17B10 3353/4885SMN1; SMN2 3294/4885NPC1 2536/4885
US-20230183188-A1 ENPP1 MODULATORS AND USES THEREOF ENPP1, ENPP2, ENPP3 HSD17B10 4035/4885SMN1; SMN2 2314/4885NPC1 2010/4885
US-20120295897-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS TRPV3, TRPC3, TRPV1 HSD17B10 2258/4885SMN1; SMN2 272/4885NPC1 804/4885

“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.