SCHEMBL4522775

SCHEMBL4522775

CCC1OC2(CCN(C)CC2)CC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.40
KCNH2 Q12809 1/20 0.40
SIGMAR1 Q99720 1/20 0.40

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
Fumaric Acid SCHEMBL8866463 0.89 SIGMAR1 (0.44) OPRM1KCNH2SIGMAR1
Maleic Acid SCHEMBL8866452 0.89 SIGMAR1 (0.44) OPRM1KCNH2SIGMAR1
SCHEMBL9279009 0.85 OPRM1 (0.42) OPRM1KCNH2SIGMAR1
SCHEMBL9252531 0.80
SCHEMBL1326512 0.77
SCHEMBL9820569 0.76
SCHEMBL8342295 0.76
SCHEMBL19852102 0.75
Ethylene SCHEMBL9699905 0.75
SCHEMBL21601991 0.74 OPRM1 (0.37) OPRM1KCNH2SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0311313-B1 Heterocyclic spiro compounds and their preparation YAMANOUCHI PHARMA CO LTD (JP) 1995-05-10 EP claimed
US-5412096-A Treatment of senile dementia, Alzheimer*s disease, cholinergic activators YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1995-05-02 US claimed
US-RE34653-E 1-oxa-8-azaspiro/4,5/decane compounds YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1994-07-05 US claimed
US-4940795-A Heterocyclic spiro compounds and methods for preparing the same YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1990-07-10 US claimed
EP-0311313-A2 Heterocyclic spiro compounds and their preparation YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1989-04-12 EP claimed
US-20090082381-A1 Percutaneously Absorbable Ophthalmic Preparation SENJU PHARMACEUTICAL CO., LTD. (JP) 2009-03-26 US disclosed
US-20080306103-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CENTRAL AND PERIPHERAL NERVOUS SYSTEM DISORDERS AND NOVEL COMPOUNDS USEFUL THEREFOR ISRAEL INSTITUTE FOR BIOLOGICAL RESEARCH 2008-12-11 US disclosed
US-7439251-B2 Methods and compositions for treatment of central and peripheral nervous system disorders and novel compounds useful therefor ISRAEL INSTITUTE FOR BIOLOGICAL RESEARCH (IL) 2008-10-21 US disclosed
EP-1917964-A1 PERCUTANEOUSLY ABSORBABLE OPHTHALMIC PREPARATION Senju Pharmaceutical Co., Ltd. (JP) 2008-05-07 EP disclosed
EP-1507765-A4 METHODS AND COMPOSITIONS FOR TREATMENT OF CENTRAL AND PERIPHERAL NERVOUS SYSTEM DISORDERS AND NOVEL COMPOUNDS USEFUL THEREFOR ISRAEL INST BIOLOG RES (IL) 2006-11-02 EP disclosed
US-7049321-B2 Methods and pharmaceutical compositions for treatment of central and peripheral nervous system disorders and compounds useful therefor ISRAEL INSTITUTE FOR BIOLOGICAL RESEARCH (IL) 2006-05-23 US disclosed
US-20060052406-A1 Methods and compositions for treatment of central and peripheral nervous system disorders and novel compounds useful therefor ISREAL INSTITUTE FOR BIOLOGICAL RESEARCH (US) 2006-03-09 US disclosed
US-5412096-A Treatment of senile dementia, Alzheimer*s disease, cholinergic activators YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1995-05-02 US disclosed
US-RE34653-E 1-oxa-8-azaspiro/4,5/decane compounds YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1994-07-05 US disclosed
EP-0490901-A1 NOVEL SPIROFURANE DERIVATIVES Astra Aktiebolag (SE) 1992-06-24 EP disclosed
US-5041549-A Cholinergin agents YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-08-20 US disclosed
US-4996210-A Cognition activators, nervous system disorders; muscarinic acetylcholine receptor agonists; 2,8-dimethyl-3-methylene-1-oxa-8-azaspiro[4.5]decane for example YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-02-26 US disclosed
WO-1990015804-A1 NOVEL SPIROFURANE DERIVATIVES FISONS CORPORATION (US) 1990-12-27 WO disclosed
US-4940795-A Heterocyclic spiro compounds and methods for preparing the same YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1990-07-10 US disclosed
EP-0311313-A2 Heterocyclic spiro compounds and their preparation YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1989-04-12 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 (3 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-20080306103-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CENTRAL AND PERIPHERAL NERVOUS SYSTEM DISORDERS AND NOVEL COMPOUNDS USEFUL THEREFOR PMP22, PYGB, GAP43 OPRM1 745/4885KCNH2 2100/4885SIGMAR1 751/4885
US-20090082381-A1 Percutaneously Absorbable Ophthalmic Preparation SLC26A4, SLC5A11, REN OPRM1 2536/4885KCNH2 1573/4885SIGMAR1 1768/4885
US-20060052406-A1 Methods and compositions for treatment of central and peripheral nervous system disorders and novel compounds useful therefor PMP22, PYGB, GAP43 OPRM1 745/4885KCNH2 2100/4885SIGMAR1 751/4885

“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.