SCHEMBL5280131

SCHEMBL5280131

CCCCCC1(O)CCNCC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.41
OPRD1 P41143 2/20 0.41
OPRK1 P41145 2/20 0.41
OPRL1 P41146 2/20 0.41
GNAI3 P08754 6/20 0.35
GNAO1 P09471 6/20 0.35
GNAI1 P63096 6/20 0.35
GAA P10253 1/20 0.33
GPR4 P46093 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL5820159 0.98 OPRM1 (0.43) OPRM1OPRD1OPRK1OPRL1GNAI3
SCHEMBL3026785 0.93 OPRM1 (0.40) OPRM1OPRD1OPRK1OPRL1GNAI3
SCHEMBL3262549 0.88 OPRM1 (0.36) OPRM1OPRD1OPRK1OPRL1GNAI3
SCHEMBL26665511 0.84 SLC6A4 (0.33) GPR4KCNH2
SCHEMBL4437885 0.84
SCHEMBL17730835 0.81 OPRM1 (0.49) OPRM1OPRD1OPRK1OPRL1
SCHEMBL17731291 0.81 OPRM1 (0.49) OPRM1OPRD1OPRK1OPRL1
SCHEMBL17607210 0.81 OPRM1 (0.49) OPRM1OPRD1OPRK1OPRL1
SCHEMBL1868334 0.81 OPRM1 (0.49) OPRM1OPRD1OPRK1OPRL1
SCHEMBL17607279 0.81 OPRM1 (0.49) OPRM1OPRD1OPRK1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0083093-A2 Process and intermediates of octahydrobenzofuro(3,2-e)isoquinolines E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-07-06 EP claimed
EP-3666757-A1 PROCESS FOR PREPARING A PIPERIDIN-4-ONE Karl-Franzens-Universität Graz (AT) 2020-06-17 EP disclosed
CN-1989124-A Quinazolin-4-yl- piperidine and cinnolin-4-yl- piperidine derivatives as pde10 inhibitors for the treatment of cns disorders PFIZER (US) 2007-06-27 CN disclosed
EP-1773805-A1 QUINAZOLIN-4-YL-PIPERIDINE AND CINNOLIN-4-YL-PIPERIDINE DERIVATIVES AS PDE10 INHIBITORS FOR THE TREATMENT OF CNS DISORDERS Pfizer Products Incorporated (US) 2007-04-18 EP disclosed
WO-2006011040-A1 QUINAZOLIN-4-YL- PIPERIDINE AND CINNOLIN-4-YL- PIPERIDINE DERIVATIVES AS PDE10 INHIBITORS FOR THE TREATMENT OF CNS DISORDERS PFIZER PRODUCTS INC. (US) 2006-02-02 WO disclosed
US-20060019975-A1 Novel piperidyl derivatives of quinazoline and isoquinoline PFIZER INC 2006-01-26 US disclosed
EP-1021185-A4 DIDHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMA CORP (US) 2005-09-07 EP disclosed
EP-0721455-B9 TETRAHYDROPYRIDINE-(OR 4-HYDROXYPIPERIDINE)ALKYLAZOLES HAVING AN AFFINITY FOR SIGMA AND/OR 5HT1A RECEPTORS ESTEVE LABOR DR (ES) 2005-04-20 EP disclosed
EP-1409476-B1 PHARMACEUTICAL COMPOUNDS WITH SEROTONIN RECEPTOR ACTIVITY LILLY CO ELI (US) 2004-12-15 EP disclosed
US-20040180883-A1 Pharmaceutical compounds with serotonin receptor activity GILMORE JEREMY (GB) 2004-09-16 US disclosed
EP-0083093-A2 Process and intermediates of octahydrobenzofuro(3,2-e)isoquinolines E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-07-06 EP disclosed
EP-0083093-A2 Process and intermediates of octahydrobenzofuro(3,2-e)isoquinolines E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-07-06 EP disclosed
US-4364954-A NEUROLEPTIC AGENT WARNER-LAMBERT COMPANY (US) 1982-12-21 US disclosed
US-4292321-A 1,3,8-Triazaspirodecane-4-ones, pharmaceutical compositions thereof and method of use thereof WARNER-LAMBERT COMPANY (US) 1981-09-29 US disclosed
US-4166853-A Antihypertensive 7-trifluoromethyl-4-aminoquinolones THE UPJOHN COMPANY (US) 1979-09-04 US disclosed
US-4086234-A Process for the preparation of tertiary amines G. D. SEARLE & CO. (US) 1978-04-25 US disclosed
US-4022786-A PHARMACEUTICALS, CNS STIMULANT BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DT) 1977-05-10 US disclosed
US-4022786-A PHARMACEUTICALS, CNS STIMULANT BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DT) 1977-05-10 US disclosed
US-4016280-A 4,4-Diarylpiperidine compositions and use BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DT) 1977-04-05 US disclosed
US-4016280-A 4,4-Diarylpiperidine compositions and use BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DT) 1977-04-05 US 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-20040180883-A1 Pharmaceutical compounds with serotonin receptor activity HTR1A, HTR5A, HTR1E OPRM1 45/4885OPRD1 39/4885OPRK1 53/4885
US-20060019975-A1 Novel piperidyl derivatives of quinazoline and isoquinoline PDE5A, PDE4A, PDE3A OPRM1 2906/4885OPRD1 1215/4885OPRK1 789/4885

“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.