SCHEMBL10513153

SCHEMBL10513153

NCC1(O)CCN(CCc2ccccc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.56
SIGMAR1 Q99720 7/20 0.54
CCR3 P51677 1/20 0.51
DRD2 P14416 2/20 0.50
HTR2A P28223 2/20 0.50
HTR2C P28335 2/20 0.50
HTR2B P41595 2/20 0.50
HTR1A P08908 1/20 0.50
NPFFR1 Q9GZQ6 1/20 0.50
NPFFR2 Q9Y5X5 1/20 0.50
KCNH2 Q12809 1/20 0.49

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
SCHEMBL10447143 0.88 SLC6A3 (0.53) SLC6A3SIGMAR1DRD2HTR2AHTR2C
SCHEMBL7245996 0.85 SLC6A3 (0.58) SLC6A3SIGMAR1DRD2HTR1A
Hydrochloric Acid SCHEMBL7248307 0.84 SLC6A3 (0.56) SLC6A3SIGMAR1
SCHEMBL1314774 0.83 OPRL1 (0.63) SIGMAR1CCR3
SCHEMBL28766506 0.83 SLC6A3 (0.50) SLC6A3SIGMAR1CCR3DRD2HTR1A
SCHEMBL10639904 0.81 SLC6A3 (0.53) SLC6A3SIGMAR1DRD2HTR2AHTR2C
SCHEMBL3885526 0.81 LTA4H (0.56) SLC6A3SIGMAR1
SCHEMBL8970787 0.81 SLC6A3 (0.56) SLC6A3SIGMAR1DRD2HTR2AHTR2C
SCHEMBL17325324 0.80 SMN1; SMN2 (0.56) SLC6A3SIGMAR1DRD2HTR2AHTR2C
SCHEMBL8971077 0.79 MAOA (0.58) SLC6A3SIGMAR1HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113122050-A Quantum dot ink and preparation method of quantum dot film TCL集团股份有限公司 2021-07-16 CN claimed
US-11649248-B2 Oxadiazaspiro compounds for the treatment of drug abuse and addiction ESTEVE PHARMACEUTICALS, S.A. (ES) 2023-05-16 US disclosed
US-11649248-B2 Oxadiazaspiro compounds for the treatment of drug abuse and addiction ESTEVE PHARMACEUTICALS, S.A. (ES) 2023-05-16 US disclosed
US-11649248-B2 Oxadiazaspiro compounds for the treatment of drug abuse and addiction ESTEVE PHARMACEUTICALS, S.A. (ES) 2023-05-16 US disclosed
CN-113122050-B Quantum dot ink and preparation method of quantum dot film TCL科技集团股份有限公司 2022-11-04 CN disclosed
EP-3377500-B1 OXADIAZASPIRO COMPOUNDS FOR THE TREATMENT OF DRUG ABUSE AND ADDICTION ESTEVE PHARMACEUTICALS SA (ES) 2022-10-19 EP disclosed
CN-113122050-A Quantum dot ink and preparation method of quantum dot film TCL集团股份有限公司 2021-07-16 CN disclosed
US-20210115062-A1 OXADIAZASPIRO COMPOUNDS FOR THE TREATMENT OF DRUG ABUSE AND ADDICTION ESTEVE PHARMACEUTICALS SA (ES) 2021-04-22 US disclosed
US-20210115062-A1 OXADIAZASPIRO COMPOUNDS FOR THE TREATMENT OF DRUG ABUSE AND ADDICTION ESTEVE PHARMACEUTICALS SA (ES) 2021-04-22 US disclosed
US-10927128-B2 Oxadiazaspiro compounds for the treatment of drug abuse and addiction ESTEVE PHARMACEUTICALS. S.A. (ES) 2021-02-23 US disclosed
US-20170197984-A1 AMIDE DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2017-07-13 US disclosed
US-20170197984-A1 AMIDE DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2017-07-13 US disclosed
US-20170101420-A1 ALKYL AND ARYL DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2017-04-13 US disclosed
US-20170101420-A1 ALKYL AND ARYL DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2017-04-13 US disclosed
US-20170101420-A1 ALKYL AND ARYL DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2017-04-13 US disclosed
WO-2015185208-A1 AMIDE DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2015-12-10 WO disclosed
WO-2015185207-A1 ALKYL AND ARYL DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2015-12-10 WO disclosed
EP-0343307-A1 4-Piperidinealkanamine derivatives FABRICA ESPANOLA DE PRODUCTOS QUIMICOS Y FARMACEUTICOS, S.A. (ES) 1989-11-29 EP disclosed
EP-0295833-A1 Aromatic-Spiropiperidine oxazepinones (and thiones) A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1988-12-21 EP disclosed
US-4746655-A ANTIHISTAMINES A. H. ROBINS COMPANY, INCORPORATED (US) 1988-05-24 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 (5 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-20170197984-A1 AMIDE DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN OPRD1, SIGMAR1, OPRM1 SLC6A3 1758/4885SIGMAR1 2/4885CCR3 616/4885
US-11649248-B2 Oxadiazaspiro compounds for the treatment of drug abuse and addiction OPRD1, OPRM1, OPRK1 SLC6A3 72/4885SIGMAR1 4/4885CCR3 2606/4885
US-20170101420-A1 ALKYL AND ARYL DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN OPRD1, SIGMAR1, OPRM1 SLC6A3 1202/4885SIGMAR1 2/4885CCR3 1323/4885
US-10927128-B2 Oxadiazaspiro compounds for the treatment of drug abuse and addiction OPRD1, OPRM1, OPRK1 SLC6A3 72/4885SIGMAR1 4/4885CCR3 2606/4885
US-20210115062-A1 OXADIAZASPIRO COMPOUNDS FOR THE TREATMENT OF DRUG ABUSE AND ADDICTION OPRD1, OPRM1, OPRK1 SLC6A3 83/4885SIGMAR1 4/4885CCR3 2546/4885

“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.