SCHEMBL2801018

SCHEMBL2801018

CC1C(O)C2CCN1CC2

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 2/20 0.38
PKM P14618 1/20 0.34
GAA P10253 2/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
NGLY1 Q96IV0 1/20 0.33
GBA2 Q9HCG7 1/20 0.33
GBA1 P04062 1/20 0.33
GANAB Q14697 1/20 0.33
CHRNA7 P36544 1/20 0.32

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
SCHEMBL3391750 1.00 SLC18A3 (0.38) SLC18A3PKMGAAMEN1CYP1A2
SCHEMBL7293477 0.83 GAA (0.34) SLC18A3GAAMEN1CYP1A2CYP2C9
SCHEMBL24705597 0.77
SCHEMBL11295539 0.77
SCHEMBL5398154 0.72 SLC18A3 (0.41) SLC18A3PKMGAAMEN1CYP1A2
SCHEMBL27816064 0.72 SLC18A3 (0.41) SLC18A3PKMGAAMEN1CYP1A2
SCHEMBL1404038 0.70 SLC18A3 (0.44) SLC18A3PKMGAAMEN1CYP1A2
Bicarbonate SCHEMBL28128479 0.69 KDM4E (0.36) SLC18A3MEN1KMT2A
SCHEMBL7281278 0.68 CHRNA7 (0.33) CHRNA7
SCHEMBL6519582 0.68 SLC18A3 (0.38) SLC18A3PKMGAAMEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3444252-B1 ELECTROCHEMICAL CELL COMPRISING A HETERO IONIC ADDITIVE NANTENERGY INC (US) 2019-08-14 EP claimed
EP-3444252-A1 SYNTHESIS OF HETERO IONIC COMPOUNDS USING DIALKYLCARBONATE QUATERNIZATION NantEnergy, Inc. (US) 2019-02-20 EP claimed
EP-3336962-B1 ELECTROCHEMICAL CELL COMPRISING ELECTROLYTE HAVING HETERO IONIC COMPLEX NANTENERGY INC (US) 2019-02-20 EP claimed
EP-3336962-A1 ELECTROCHEMICAL CELL COMPRISING ELECTROLYTE HAVING HETERO IONIC COMPLEX Fluidic, Inc. (US) 2018-06-20 EP claimed
US-9793586-B2 Synthesis of hetero compounds using dialkylcarbonate quaternation FLUIDIC, INC. (US) 2017-10-17 US claimed
US-9768472-B2 Synthesis of hetero ionic compounds using dialkylcarbonate quaternization FLUIDIC, INC. (US) 2017-09-19 US claimed
US-20170233877-A9 SYNTHESIS OF HETERO COMPOUNDS USING DIALKYLCARBONATE QUATERNATION FLUIDIC, INC. (US) 2017-08-17 US claimed
US-20170092989-A1 SYNTHESIS OF HETERO IONIC COMPOUNDS USING DIALKYLCARBONATE QUATERNIZATION FLUIDIC, INC. 2017-03-30 US claimed
EP-2721037-A1 SYNTHESIS OF HETERO IONIC COMPOUNDS USING DIALKYLCARBONATE QUATERNIZATION Fluidic, Inc. (US) 2014-04-23 EP claimed
US-20120321969-A1 SYNTHESIS OF HETERO COMPOUNDS USING DIALKYLCARBONATE QUATERNATION FLUIDIC, INC. (US) 2012-12-20 US claimed
WO-2012174564-A1 SYNTHESIS OF HETERO IONIC COMPOUNDS USING DIALKYLCARBONATE QUATERNIZATION FLUIDIC, INC. (US) 2012-12-20 WO claimed
EP-2457911-A1 3-(heteroaryl-oxy)-2-alkyl-1-aza-bicycloalkyl derivatives as alpha.7-nAChR ligands for the treatment of CNS diseases. Novartis AG (CH) 2012-05-30 EP claimed
US-20080194573-A1 Psychological and neurodegenerative disorders; nicotinic acetylcholine receptors NOVARTIS AG (CH) 2008-08-14 US claimed
EP-1776360-A1 3-(HETEROARYL-OXY)-2-ALKYL-1-AZA-BICYCLOALKYL DERIVATIVES AS ALPHA.7-NACHR LIGANDS FOR THE TREATMENT OF CNS DISEASES. Novartis AG (CH) 2007-04-25 EP claimed
WO-2006005608-A1 3-(HETEROARYL-OXY)-2-ALKYL-1-AZA-BICYCLOALKYL DERIVATIVES AS ALPHA.7-NACHR LIGANDS FOR THE TREATMENT OF CNS DISEASES NOVARTIS AG (CH) 2006-01-19 WO claimed
EP-4559918-A2 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS Genzyme Corporation (US) 2025-05-28 EP disclosed
EP-3673906-B1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORP (US) 2025-05-14 EP disclosed
US-6124354-A TREATMENT OF URINARY INCONTINENCE OR IRRITABLE BOWEL SYNDROME PHARMACIA & UPJOHN AB (SE) 2000-09-26 US disclosed
EP-0923536-A1 ARYLCYCLOALKANE CARBOXYLIC ESTERS, THEIR USE, PHARMACEUTICAL COMPOSITIONS AND PREPARATION Pharmacia & Upjohn Aktiebolag (SE) 1999-06-23 EP disclosed
WO-1998004517-A1 ARYLCYCLOALKANE CARBOXYLIC ESTERS, THEIR USE, PHARMACEUTICAL COMPOSITIONS AND PREPARATION PHARMACIA & UPJOHN AB (SE) 1998-02-05 WO 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 (1 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-20080194573-A1 Psychological and neurodegenerative disorders; nicotinic acetylcholine receptors CHRNA7, CHRNA5, CHRNA6 SLC18A3 33/4885PKM 4168/4885GAA 1025/4885

“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.