SCHEMBL1497934

SCHEMBL1497934

[CH2]COC(=O)C1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
MAPT P10636 2/20 0.33
LGMN Q99538 1/20 0.32
PDE4D Q08499 1/20 0.32
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
PPM1B O75688 1/20 0.30
PTPN1 P18031 1/20 0.30
PIK3CD O00329 1/20 0.30
PPP1CC P36873 1/20 0.30

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
SCHEMBL6076980 0.84
SCHEMBL11464729 0.84 MAPT (0.37) ADRB2ADRB1ADRB3MAPTNPC1
SCHEMBL3998210 0.81 MAPT (0.33) ADRB2ADRB1ADRB3MAPTLGMN
SCHEMBL1439554 0.80 ALDH1A1 (0.44) ADRB2ADRB1ADRB3MAPTALDH1A1
SCHEMBL18795947 0.79 MAPT (0.36) ADRB2ADRB1ADRB3MAPTLGMN
SCHEMBL72855 0.79 MAPT (0.51) MAPTLGMNNPC1ALDH1A1LMNA
SCHEMBL22356161 0.79 LGMN (0.35) ADRB2ADRB1ADRB3MAPTLGMN
SCHEMBL4791108 0.79 KMT2A (0.36) ADRB2ADRB1ADRB3MAPTLGMN
SCHEMBL707156 0.78 ALDH1A1 (0.47) ADRB2ADRB1ADRB3MAPTALDH1A1
SCHEMBL9032992 0.78 ALDH1A1 (0.47) ADRB2ADRB1ADRB3MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024054279-A1 SHORT-ACTING 3,4-METHYLENEDIOXYMETHAMPHETAMINE (MDMA) ANALOGS INCORPORATING BENZOTHIAZOLE MYDECINE INNOVATIONS GROUP INC. (US) 2024-03-14 WO disclosed
EP-3353164-A1 BI-HETEROARYL SUBSTITUTED 1,4-BENZODIAZEPINES AND USES THEREOF FOR THE TREATMENT OF CANCER Janssen Pharmaceutica, N.V. (BE) 2018-08-01 EP disclosed
EP-3353177-A1 NEW COMPOUNDS Janssen Pharmaceutica, N.V. (BE) 2018-08-01 EP disclosed
WO-2017050865-A1 BI-HETEROARYL SUBSTITUTED 1,4-BENZODIAZEPINES AND USES THEREOF FOR THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA NV (BE) 2017-03-30 WO disclosed
WO-2017050864-A1 NEW COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2017-03-30 WO disclosed
EP-3122742-A1 QUINOXALINE DERIVATIVES USEFUL AS FGFR KINASE MODULATORS Astex Therapeutics Ltd (GB) 2017-02-01 EP disclosed
WO-2015144803-A1 QUINOXALINE DERIVATIVES USEFUL AS FGFR KINASE MODULATORS ASTEX THERAPEUTICS LTD (GB) 2015-10-01 WO disclosed
US-9078874-B2 Composition and method for treating cognitive impairments in down syndrom subjects Centre National de la Recherche Scientifique—CNRS (FR) 2015-07-14 US disclosed
EP-2470176-B1 COMPOSITION AND METHOD FOR TREATING COGNITIVE IMPAIRMENTS IN DOWN SYNDROM SUBJECTS CENTRE NAT RECH SCIENT (FR) 2014-12-10 EP disclosed
EP-2332909-B1 HYDROXYBENZAMIDE DERIVATIVES AND THEIR USE AS INHIBITORS OF HSP90 ASTEX THERAPEUTICS LTD (GB) 2014-10-15 EP disclosed
WO-2004014922-A1 3-(CARBONYL) 1H-INDAZOLE COMPOUNDS AS CYCLIN DEPENDENT KINASES (CDK) INHIBITORS ASTEX TECHNOLOGY LIMITED (GB) 2004-02-19 WO disclosed
US-5686461-A INHIBITION OF NMDA INDUCED CONVULSIONS GLAXO WELLCOME S.P.A. (IT) 1997-11-11 US disclosed
US-5576312-A 1-azatricyclo[7.2.0.03,8 ]undec-2-ene-2-carboxylates as antibacterial compounds GLAXO SPA (IT) 1996-11-19 US disclosed
EP-0699186-A1 INDOLE DERIVATIVES AS ANTAGONISTS OF EXCITATORY AMINO ACIDS GLAXO S.p.A. (IT) 1996-03-06 EP disclosed
EP-0656899-A1 CONDENSED CARBAPENEM DERIVATIVES GLAXO S.p.A. (IT) 1995-06-14 EP disclosed
US-5374649-A Nervous system disorders GLAXO S.P.A. (IT) 1994-12-20 US disclosed
US-5374648-A Nervous system disorders GLAXO S.P.A. (IT) 1994-12-20 US disclosed
WO-1994020465-A1 INDOLE DERIVATIVES AS ANTAGONISTS OF EXCITATORY AMINO ACIDS GLAXO S.P.A. (IT) 1994-09-15 WO disclosed
WO-1994005666-A1 CONDENSED CARBAPENEM DERIVATIVES GLAXO S.P.A. (IT) 1994-03-17 WO disclosed
EP-0568136-A1 Indole-2-carboxylic acid derivatives GLAXO S.p.A. (IT) 1993-11-03 EP disclosed