SCHEMBL867848

SCHEMBL867848

O=C(O)N1CCc2nc(Cl)ccc2C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 1/20 0.48
GRM5 P41594 1/20 0.44
HPGD P15428 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
HSP90AB1 P08238 3/20 0.39
ESR1 P03372 4/20 0.38
ESR2 Q92731 4/20 0.38
PDGFRB P09619 2/20 0.38
HSP90AA1 P07900 1/20 0.38
NPC1 O15118 1/20 0.37
TP53 P04637 1/20 0.37
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
CDK4 P11802 1/20 0.36
CDK2 P24941 1/20 0.36
CDK6 Q00534 1/20 0.36
PTGS1 P23219 1/20 0.35
ENPP2 Q13822 1/20 0.35

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
SCHEMBL27963690 0.88 ABHD6 (0.48) ABHD6GRM5HPGDSMN1; SMN2ESR1
SCHEMBL3261690 0.86 NOTUM (0.51) ABHD6GRM5HPGDHSP90AB1HSP90AA1
SCHEMBL20483717 0.86 ABHD6 (0.47) ABHD6GRM5HPGDSMN1; SMN2HSP90AB1
SCHEMBL867784 0.85 ABHD6 (0.58) ABHD6GRM5HPGDSMN1; SMN2HSP90AB1
SCHEMBL28106793 0.84 DHFR (0.39) ABHD6SMN1; SMN2HSP90AB1PDGFRBHSP90AA1
SCHEMBL1507101 0.82 KEAP1 (0.48) ABHD6GRM5HPGDALDH1A1LMNA
SCHEMBL22544433 0.82 NPC1 (0.48) ABHD6GRM5HPGDSMN1; SMN2HSP90AB1
SCHEMBL1040442 0.82 ABHD6 (0.50) ABHD6GRM5HPGDSMN1; SMN2HSP90AB1
SCHEMBL30575054 0.81 ABHD6 (0.49) ABHD6GRM5ESR1ESR2
SCHEMBL28835263 0.81 ABHD6 (0.39) ABHD6GRM5LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112805063-B Bicyclic derivatives as modulators of the GABAA A5 receptor 吉瑞工厂 2024-02-23 CN disclosed
WO-2024038129-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS MIRONID LIMITED (GB) 2024-02-22 WO disclosed
CN-114075219-B Quinoline condensed ring derivative, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2023-11-14 CN disclosed
CN-116848122-A Plasmin inhibitor, preparation method and application thereof 赛诺哈勃药业(成都)有限公司 2023-10-03 CN disclosed
CN-116710440-A Plasmin inhibitor, preparation method and application thereof 赛诺哈勃药业(成都)有限公司 2023-09-05 CN disclosed
CN-115703776-A Plasmin inhibitor, preparation method and application thereof 赛诺哈勃药业(成都)有限公司 2023-02-17 CN disclosed
WO-2022143911-A1 PLASMIN INHIBITOR, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 赛诺哈勃药业(成都)有限公司 2022-07-07 WO disclosed
CN-114630822-A Biaryl dihydroorotate dehydrogenase inhibitors 詹森生物科技公司 2022-06-14 CN disclosed
CN-108727368-B Nitrogen-containing fused heterocyclic compound, preparation method, intermediate, composition and application thereof 上海医药集团股份有限公司 2022-05-03 CN disclosed
CN-114340634-A Heterocyclic compounds as kinase inhibitors 诺维逊生物股份有限公司 2022-04-12 CN disclosed
CN-103703000-B The fused tricyclic double inhibitor of CDK4/6 and FLT3 AMGEN INC. (US) 2015-11-25 CN disclosed
CN-103958478-A Novel bicyclic dihydroisoquinolin-1-one derivatives HOFFMANN LA ROCHE 2014-07-30 CN disclosed
CN-103703000-A Fused tricyclic dual inhibitors of CDK 4/6 and FLT3 AMGEN INC 2014-04-02 CN disclosed
EP-2621914-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS GLYCOGEN SYNTHASE KINASE-3 INHIBITORS Abbott GmbH & Co. KG (DE) 2013-08-07 EP disclosed
WO-2012041814-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS GLYCOGEN SYNTHASE KINASE-3 INHIBITORS ABBOTT GMBH & CO. KG (DE) 2012-04-05 WO disclosed
US-20120077840-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS GLYCOGEN SYNTHASE KINASE-3 INHIBITORS ABBOTT GMBH & CO. KG (DE) 2012-03-29 US disclosed
US-20110046130-A1 TETRAHYDRONAPHTHYRIDINES AND AZA DERIVATIVES THEREOF AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC AG (DE) 2011-02-24 US disclosed
EP-2268638-A1 TETRAHYDRONAPHTHYRIDINES AND AZA DERIVATIVES THEREOF AS HISTAMINE H3 RECEPTOR ANTAGONISTS Evotec AG (DE) 2011-01-05 EP disclosed
WO-2010052222-A1 (DIHYDRO)NAPHTHYRIDINONE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2010-05-14 WO disclosed
WO-2009121812-A1 TETRAHYDRONAPHTHYRIDINES AND AZA DERIVATIVES THEREOF AS HISTAMINE H3 RECEPTOR ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2009-10-08 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 (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-20110046130-A1 TETRAHYDRONAPHTHYRIDINES AND AZA DERIVATIVES THEREOF AS HISTAMINE H3 RECEPTOR ANTAGONISTS HRH4, HRH3, HRH1 ABHD6 3500/4885GRM5 125/4885HPGD 471/4885
US-20120077840-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS GLYCOGEN SYNTHASE KINASE-3 INHIBITORS GSK3B, GSK3A, GYS2 ABHD6 3324/4885GRM5 3497/4885HPGD 1279/4885

“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.