SCHEMBL9388337

SCHEMBL9388337

CN1CCC(ON2C(=O)c3ccccc3C2=O)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.53
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
SCN1A P35498 4/20 0.47
SCN2A Q99250 4/20 0.47
SCN3A Q9NY46 4/20 0.47
CHRM1 P11229 2/20 0.45
CHRM2 P08172 1/20 0.45
HTR1A P08908 1/20 0.45
ADRA2A P08913 1/20 0.45
CYP2D6 P10635 1/20 0.45
DRD1 P21728 1/20 0.45
SLC6A2 P23975 1/20 0.45
ADRA1A P35348 1/20 0.45
OPRM1 P35372 1/20 0.45
DRD3 P35462 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KCNH2 Q12809 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45
CHRM3 P20309 3/20 0.44

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
SCHEMBL9387274 0.90 ACHE (0.50) ACHEMEN1KMT2ASCN1ASCN2A
SCHEMBL26931611 0.86 GAA (0.46) ACHEMEN1KMT2ACHRM2OPRM1
SCHEMBL30728974 0.86 GAA (0.46) ACHEMEN1KMT2ACHRM2OPRM1
SCHEMBL15452482 0.83 GAA (0.39) ACHEMEN1KMT2ACHRM2OPRM1
SCHEMBL24130978 0.82 ALDH1A1 (0.43) MEN1KMT2ACHRM2OPRM1ALDH1A1
SCHEMBL30002131 0.82 ALDH1A1 (0.47) KMT2ACHRM2OPRM1ALDH1A1
SCHEMBL2077862 0.82 ALDH1A1 (0.47) KMT2ACHRM2OPRM1ALDH1A1
SCHEMBL9391216 0.81 MEN1 (0.48) ACHEMEN1KMT2ACHRM1CHRM2
SCHEMBL2643585 0.81 ALDH1A1 (0.50) KMT2AMAPK1ALDH1A1
SCHEMBL10848836 0.81 ALDH1A1 (0.50) KMT2AMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10544146-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2020-01-28 US disclosed
US-10544146-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2020-01-28 US disclosed
US-10030019-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2018-07-24 US disclosed
US-10030019-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2018-07-24 US disclosed
US-10030019-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2018-07-24 US disclosed
US-9505761-B2 Bicyclic compounds and their use as antibacterial agents and beta-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2016-11-29 US disclosed
US-9505761-B2 Bicyclic compounds and their use as antibacterial agents and beta-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2016-11-29 US disclosed
US-9505761-B2 Bicyclic compounds and their use as antibacterial agents and beta-lactamase inhibitors FEDORA PHARMACEUTICALS INC. (CA) 2016-11-29 US disclosed
US-20160297817-A1 BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS FEDORA PHARMACEUTICALS INC. (CA) 2016-10-13 US disclosed
US-20160297817-A1 BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS FEDORA PHARMACEUTICALS INC. (CA) 2016-10-13 US disclosed
US-8796257-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors NAEJA PHARMACEUTICAL INC. (CA) 2014-08-05 US disclosed
US-8796257-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors NAEJA PHARMACEUTICAL INC. (CA) 2014-08-05 US disclosed
US-8796257-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors NAEJA PHARMACEUTICAL INC. (CA) 2014-08-05 US disclosed
WO-2014091268-A1 NEW BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND β-LACTAMASE INHIBITORS NAEJA PHARMACEUTICAL INC. (CA) 2014-06-19 WO disclosed
US-20130281359-A1 NEW BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS FEDORA PHARMACEUTICALS INC. (CA) 2013-10-24 US disclosed
US-20130281359-A1 NEW BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS FEDORA PHARMACEUTICALS INC. (CA) 2013-10-24 US disclosed
US-20130281359-A1 NEW BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS FEDORA PHARMACEUTICALS INC. (CA) 2013-10-24 US disclosed
US-20130225554-A1 NEW BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS NAEJA PHARMACEUTICAL INC. (CA) 2013-08-29 US disclosed
WO-1994000448-A1 AZACYCLIC AND AZABICYCLIC HYDROXYLAMINES AS MUSCARINIC RECEPTOR AGONISTS BOEHRINGER INGELHEIM ITALIA S.P.A. (IT) 1994-01-06 WO disclosed
US-5086051-A 1H, 3H-pyrrolo[1,2-c]thiazole-7-carboxamide derivatives and pharmaceutical compositions containing them RHONE-POULENC SANTE (FR) 1992-02-04 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-20160297817-A1 BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS NR0B1, NR0B2, NR2E1 ACHE 1628/4885MEN1 2361/4885KMT2A 1869/4885
US-10544146-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors NR0B1, NR2E1, NR0B2 ACHE 1833/4885MEN1 2440/4885KMT2A 1744/4885
US-20130281359-A1 NEW BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS MRPL21, MGAM, BACE1 ACHE 136/4885MEN1 1403/4885KMT2A 1328/4885
US-20130225554-A1 NEW BICYCLIC COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS AND BETA-LACTAMASE INHIBITORS NR0B1, NR2E1, NR0B2 ACHE 2156/4885MEN1 2283/4885KMT2A 2047/4885
US-10030019-B2 Bicyclic compounds and their use as antibacterial agents and β-lactamase inhibitors NR0B1, NR2E1, NR0B2 ACHE 1833/4885MEN1 2440/4885KMT2A 1744/4885

“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.