SCHEMBL3409130

SCHEMBL3409130

CC(=O)ON1CCN(C)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.48
CYP1A2 P05177 1/20 0.48
PAOX Q6QHF9 1/20 0.36
CA12 O43570 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
HTT P42858 1/20 0.35
HTR1A P08908 1/20 0.34
LMNA P02545 2/20 0.34
NPSR1 Q6W5P4 1/20 0.33
CHRM1 P11229 1/20 0.32
HSD11B1 P28845 1/20 0.31
HSD17B10 Q99714 1/20 0.31
POLB P06746 1/20 0.31

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
Hydrochloric Acid SCHEMBL27818530 0.98 CYP1A2 (0.46) TDP1CYP1A2PAOXCA12CA2
SCHEMBL7216698 0.89
SCHEMBL31591139 0.89 ALDH1A1 (0.37) TDP1CYP1A2LMNACHRM1HSD17B10
SCHEMBL29052233 0.89 ALDH1A1 (0.37) TDP1CYP1A2LMNACHRM1HSD17B10
Methane SCHEMBL28946775 0.87
SCHEMBL30776079 0.82 ALDH1A1 (0.32)
SCHEMBL9120653 0.82 CHRM2 (0.33) CHRM1
SCHEMBL9596546 0.82 CYP1A2 (0.44) TDP1CYP1A2PAOXCA12CA2
SCHEMBL29958708 0.81 PAOX (0.38) TDP1PAOXNPSR1POLB
SCHEMBL5681764 0.80 CYP1A2 (0.42) TDP1CYP1A2PAOXCA12CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114269744-B Methods for preparing Toll-like receptor modulator compounds 吉利德科学公司 2024-10-18 CN claimed
CN-114269744-A Methods for preparing Toll-like receptor modulator compounds 吉利德科学公司 2022-04-01 CN claimed
CN-113552241-A Method for determining residual content of 4-methylpiperazine-1-formate genotoxic impurities in zopiclone 江苏天士力帝益药业有限公司 2021-10-26 CN claimed
CN-101248048-B Imidazole based LXR modulators EXELIXIS INC 2013-08-28 CN claimed
EP-1503980-A2 SUBSTITUTED HYDROXYETHYLAMINES Elan Pharmaceuticals, Inc. (US) 2005-02-09 EP claimed
WO-2003072535-A2 SUBSTITUTED HYDROXYETHYLAMINES ELAN PHARMACEUTICALS, INC. (US) 2003-09-04 WO claimed
EP-4615842-A1 TOLL-LIKE RECEPTOR 7 AGONISTS AS IMMUNE-STIMULATORS TO ELICIT THE INNATE ANTITUMOR IMMUNITY Merck Patent GmbH (DE) 2025-09-17 EP disclosed
CN-119371422-A Methods for preparing Toll-like receptor modulator compounds 吉利德科学公司 2025-01-28 CN disclosed
CN-114269744-B Methods for preparing Toll-like receptor modulator compounds 吉利德科学公司 2024-10-18 CN disclosed
CN-118420697-A C-12-Pyxinol derivative, preparation method and application thereof 烟台大学 2024-08-02 CN disclosed
EP-4384493-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd (KY) 2024-06-19 EP disclosed
WO-2024100093-A1 TOLL-LIKE RECEPTOR 7 AGONISTS AS IMMUNE-STIMULATORS TO ELICIT THE INNATE ANTITUMOR IMMUNITY MERCK PATENT GMBH (DE) 2024-05-16 WO disclosed
EP-4367111-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2024-05-15 EP disclosed
EP-1238974-A1 HETEROCYCLE DERIVATIVES AND DRUGS Nippon Shinyaku Co., Ltd. (JP) 2002-09-11 EP disclosed
EP-0580633-B1 HETEROCYCLIC AMINES USEFUL IN THE THERAPY OF ASTHMA AND INFLAMMATION OF THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA (IT) 1998-06-17 EP disclosed
EP-0580633-A1 HETEROCYCLIC AMINES USEFUL IN THE THERAPY OF ASTHMA AND INFLAMMATION OF THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1994-02-02 EP disclosed
WO-1992018478-A1 HETEROCYCLIC AMINES USEFUL IN THE THERAPY OF ASTHMA AND INFLAMMATION OF THE RESPIRATORY TRACT BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1992-10-29 WO disclosed
EP-0096870-B1 ESTER OF METRONIDAZOLE WITH N,N-DIMETHYLGLYCINE AND ACID ADDITION SALT THEREOF A/S Dumex (Dumex Ltd.) (DK) 1986-10-01 EP disclosed
US-4482722-A FOR PARENTERAL ADMINISTRATION A/S DUMEX (DUMEX LTD.) (DK) 1984-11-13 US disclosed
EP-0096870-A1 Ester of metronidazole with N,N-dimethylglycine and acid addition salt thereof A/S Dumex (Dumex Ltd.) (DK) 1983-12-28 EP disclosed