SCHEMBL1282302

SCHEMBL1282302

CN1CCC(C(=O)ONC(=O)OC(C)(C)C)CC1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.45
KMT2A Q03164 1/20 0.45
CTSK P43235 2/20 0.40
HRH3 Q9Y5N1 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.37
BTK Q06187 1/20 0.37
RECQL P46063 1/20 0.35
PTPN2 P17706 1/20 0.35
PTPN1 P18031 1/20 0.35
PTPN6 P29350 1/20 0.35
TP53 P04637 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
GAA P10253 1/20 0.34
DRD2 P14416 1/20 0.34

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
SCHEMBL21624842 0.91 CTSK (0.42) MEN1ALDH1A1TSHRKMT2ACTSK
SCHEMBL28759084 0.88 MEN1 (0.41) MEN1ALDH1A1TSHRKMT2ACTSK
SCHEMBL2540692 0.87 BTK (0.42) MEN1ALDH1A1TSHRKMT2ACTSK
SCHEMBL28974214 0.84 SMN1; SMN2 (0.49) MEN1ALDH1A1TSHRKMT2ACTSK
SCHEMBL1771267 0.83 BTK (0.51) MEN1ALDH1A1TSHRKMT2ACTSK
SCHEMBL4706132 0.83 BTK (0.47) MEN1ALDH1A1TSHRKMT2ACTSK
SCHEMBL3918859 0.82 BTK (0.46) MEN1ALDH1A1TSHRKMT2ACTSK
SCHEMBL10274867 0.81 HRH3 (0.55) MEN1ALDH1A1TSHRKMT2AHRH3
SCHEMBL28607233 0.81 BTK (0.39) MEN1ALDH1A1TSHRKMT2ACTSK
SCHEMBL28558390 0.80 BTK (0.42) MEN1ALDH1A1TSHRKMT2ACTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111278840-B Pyrrolo [2,3-B ] pyridine compounds and their use for the treatment of cancer 癌症研究科技有限公司 2023-11-17 CN disclosed
CN-115884963-A Peptides for the treatment of medical conditions 人福医药美国公司 2023-03-31 CN disclosed
CN-114615976-A Kappa opioid receptor peptide amide agonists 人福医药美国公司 2022-06-10 CN disclosed
CN-109280075-B Peptide amide compound, preparation method and medical application thereof 四川海思科制药有限公司 2022-05-20 CN disclosed
CN-110177786-B Substituted pyrazolo [1,5-A ] pyridine compounds as RET kinase inhibitors 阿雷生物药品公司 2021-12-14 CN disclosed
CN-113461670-A Novel compounds as inhibitors of rearrangement kinase during transfection 南京天印健华医药科技有限公司 2021-10-01 CN disclosed
CN-107849047-B Biphenyl derivative, preparation method and medical application thereof 四川海思科制药有限公司 2021-01-15 CN disclosed
CN-106795146-B Isoxazole derivatives as inhibitors of mutant isocitrate dehydrogenase 1 第一三共株式会社 2020-06-26 CN disclosed
CN-111278840-A Pyrrolo [2, 3-B ] pyridine compounds and their use for treating cancer 癌症研究科技有限公司 2020-06-12 CN disclosed
CN-105188694-B Sodium channel modulators for the treatment of pain 卓莫赛尔公司 2018-07-31 CN disclosed
CN-105188694-A Sodium channel modulators for the treatment of pain CHROMOCELL CORP 2015-12-23 CN disclosed
US-9181234-B2 Antibacterial compounds BIOTA EUROPE LTD. (GB) 2015-11-10 US disclosed
EP-2625178-A1 BACTERIA TOPOISOMERASE II INHIBITING 2-ETHYLCARBAMOYLAMINO-1, 3-BENZOTHIAZOL-5-YLS Biota Europe Ltd (GB) 2013-08-14 EP disclosed
US-20120088750-A1 ANTIBACTERIAL COMPOUNDS BIOTA EUROPE LTD. (GB) 2012-04-12 US disclosed
WO-2012045124-A1 BACTERIA TOPOISOMERASE II INHIBITING 2-ETHYLCARBAMOYLAMINO-1, 3-BENZOTHIAZOL-5-YLS BIOTA EUROPE LTD (GB) 2012-04-12 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 (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-20120088750-A1 ANTIBACTERIAL COMPOUNDS MRPL21, NISCH, LSS MEN1 3233/4885ALDH1A1 2614/4885TSHR 4518/4885

“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.