SCHEMBL6944406

SCHEMBL6944406

ON=C1CCN(CCc2ccccc2)CC1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.59
SIGMAR1 Q99720 2/20 0.58
HTR1A P08908 1/20 0.53
DRD2 P14416 1/20 0.53
ACHE P22303 1/20 0.51
CCR3 P51677 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
KCNH2 Q12809 1/20 0.50

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
SCHEMBL8114316 1.00 SLC6A3 (0.59) SLC6A3SIGMAR1HTR1ADRD2ACHE
Hydrochloric Acid SCHEMBL10464381 0.98 SLC6A3 (0.58) SLC6A3SIGMAR1HTR1ADRD2ACHE
SCHEMBL3958997 0.90 SIGMAR1 (0.66) SIGMAR1
SCHEMBL17533381 0.83 SLC6A3 (0.59) SLC6A3SIGMAR1HTR1ADRD2ACHE
SCHEMBL7270268 0.82 SIGMAR1 (0.61) SIGMAR1ACHEMEN1KMT2A
SCHEMBL6948856 0.80 GAA (0.40) SLC6A3SIGMAR1MEN1KMT2A
SCHEMBL5180843 0.79 HRH3 (0.44) SLC6A3SIGMAR1
SCHEMBL13150782 0.79 SLC6A3 (0.83) SLC6A3SIGMAR1HTR1ADRD2ACHE
SCHEMBL14407778 0.79 SLC6A3 (0.83) SLC6A3SIGMAR1HTR1ADRD2ACHE
SCHEMBL6056974 0.79 SLC6A3 (0.83) SLC6A3SIGMAR1HTR1ADRD2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3183232-A1 SUBSTITUTED 1-ARYLETHYL-4-ACYLAMINOPIPERIDINE DERIVATIVES AS OPIOID/ALPHA-ADRENORECEPTOR MODULATORS AND METHOD OF THEIR PREPARATION The Arizona Board of Regents on behalf of The University of Arizona (US) 2017-06-28 EP claimed
US-20160052882-A1 Substituted 1-arylethyl-4-acylaminopiperidine derivatives as opioid/alpha-adrenoreceptor modulators and method of their preparation THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2016-02-25 US claimed
WO-2016029218-A1 SUBSTITUTED 1-ARYLETHYL-4-ACYLAMINOPIPERIDINE DERIVATIVES AS OPIOID/ALPHA-ADRENORECEPTOR MODULATORS AND METHOD OF THEIR PREPARATION THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2016-02-25 WO claimed
US-20250073217-A1 SMALL MOLECULE ADRENORECEPTOR ANTAGONISTS AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2025-03-06 US disclosed
WO-2023133135-A2 SMALL MOLECULE ADRENORECEPTOR ANTAGONISTS AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2023-07-13 WO disclosed
EP-3183232-B1 SUBSTITUTED 1-ARYLETHYL-4-ACYLAMINOPIPERIDINE DERIVATIVES AS OPIOID/ALPHA-ADRENORECEPTOR MODULATORS AND METHOD OF THEIR PREPARATION UNIV ARIZONA (US) 2023-05-03 EP disclosed
EP-3183232-B1 SUBSTITUTED 1-ARYLETHYL-4-ACYLAMINOPIPERIDINE DERIVATIVES AS OPIOID/ALPHA-ADRENORECEPTOR MODULATORS AND METHOD OF THEIR PREPARATION UNIV ARIZONA (US) 2023-05-03 EP disclosed
US-11440885-B2 Substituted 1-arylalkyl-4-acylaminopiperidine compounds and methods of producing and using the same ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERISTY OF ARIZONA (US) 2022-09-13 US disclosed
US-20200222380-A1 Substituted 1-Arylalkyl-4-Acylaminopiperidine Compounds and Methods of Producing and Using the Same ARIZONA BOARD OF REGENTS on behalf of THE UNIVERSITY OF ARIZONA, A BODY CORPORATE (US) 2020-07-16 US disclosed
US-10617681-B2 1-arylalkyl-4-acylaminopiperidine compounds ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2020-04-14 US disclosed
US-20190134018-A1 1-ARYLALKYL-4-ACYLAMINOPIPERIDINE COMPOUNDS ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2019-05-09 US disclosed
US-6642231-B2 Antineoplastic agents, treatment for neuronal injury and degeneration AVENTIS PHARMACEUTICALS INC. 2003-11-04 US disclosed
EP-1056744-B1 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES AVENTIS PHARMA INC (US) 2003-10-22 EP disclosed
US-20030105098-A1 6,9-disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines AVENTISUB II INC. 2003-06-05 US disclosed
US-6479487-B1 INHIBIT CYCLIN DEPENDENT KINASES, PARTICULARLY CDK-2; ANTIAPOPTOSIS AGENT; INHIBITS DEVELOPMENT OF NEOPLASMS AVENTIS PHARMACEUTICALS INC. 2002-11-12 US disclosed
EP-1056744-A1 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES Aventis Pharmaceuticals Inc. (US) 2000-12-06 EP disclosed
WO-1999043675-A1 6,9-DISUBSTITUTED 2-[TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES AVENTIS PHARMACEUTICALS INC. (US) 1999-09-02 WO disclosed
US-4954506-A ANALGESICS, NARCOTIC ANTAGONISTS BOC, INC. (US) 1990-09-04 US disclosed
US-4916142-A N-heterocyclic-N-(4-piperidinyl)amides and pharmaceutical compositions and their use as analgesics BOC, INC. (US) 1990-04-10 US disclosed
US-4912109-A Narcotic antagonist BOC, INC. (US) 1990-03-27 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 (7 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-20030105098-A1 6,9-disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines CDK6, CDK5, CDK2 SLC6A3 1347/4885SIGMAR1 4659/4885HTR1A 1989/4885
US-20250073217-A1 SMALL MOLECULE ADRENORECEPTOR ANTAGONISTS AND USES THEREOF OPRL1, OPRK1, OPRM1 SLC6A3 758/4885SIGMAR1 46/4885HTR1A 264/4885
US-20160052882-A1 Substituted 1-arylethyl-4-acylaminopiperidine derivatives as opioid/alpha-adrenoreceptor modulators and method of their preparation OPRD1, OPRK1, OPRM1 SLC6A3 566/4885SIGMAR1 15/4885HTR1A 164/4885
US-20200222380-A1 Substituted 1-Arylalkyl-4-Acylaminopiperidine Compounds and Methods of Producing and Using the Same HRH4, OPRL1, OPRK1 SLC6A3 542/4885SIGMAR1 70/4885HTR1A 157/4885
US-20190134018-A1 1-ARYLALKYL-4-ACYLAMINOPIPERIDINE COMPOUNDS NR5A2, NR0B1, NR4A3 SLC6A3 1669/4885SIGMAR1 294/4885HTR1A 467/4885
US-11440885-B2 Substituted 1-arylalkyl-4-acylaminopiperidine compounds and methods of producing and using the same HRH4, OPRL1, OPRK1 SLC6A3 542/4885SIGMAR1 70/4885HTR1A 157/4885
US-10617681-B2 1-arylalkyl-4-acylaminopiperidine compounds NR5A2, NR0B1, NR4A3 SLC6A3 1669/4885SIGMAR1 294/4885HTR1A 467/4885

“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.