SCHEMBL19853433

SCHEMBL19853433

CC(C)CC(C)(C)OC(N)=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.35
GRM2 Q14416 1/20 0.34
GRM3 Q14832 1/20 0.34
LMNA P02545 5/20 0.33
TSHR P16473 3/20 0.33
CYP2C9 P11712 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
MAPT P10636 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALOX15 P16050 1/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
CYP3A4 P08684 3/20 0.31
NFKB1 P19838 2/20 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
SCHEMBL28012865 0.83 LMNA (0.31) LMNATSHRCYP2C9CHRM2CHRM4
SCHEMBL28012864 0.83 LMNA (0.31) LMNATSHRCYP2C9CHRM2CHRM4
SCHEMBL27632708 0.83 LMNA (0.31) LMNATSHRCYP2C9CHRM2CHRM4
SCHEMBL27891101 0.82 MMP8 (0.35) MMP8GRM2GRM3LMNATSHR
SCHEMBL609954 0.81 MMP8 (0.37) MMP8GRM2GRM3CYP2C19TDP1
SCHEMBL27721862 0.81 LMNA (0.34) LMNATSHRCYP2C9CHRM2CHRM4
SCHEMBL27403747 0.81 LMNA (0.33) LMNATSHRCYP2C9CHRM2CHRM4
SCHEMBL27717113 0.81 LMNA (0.34) LMNATSHRCYP2C9CHRM2CHRM4
SCHEMBL28132589 0.81 LMNA (0.33) LMNATSHRCYP2C9CHRM2CHRM4
SCHEMBL28132590 0.81 LMNA (0.33) LMNATSHRCYP2C9CHRM2CHRM4

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1976921-A Crystalline forms of (3R) -1- (2-methylalanyl-D-tryptophyl) -3- (phenylmethyl) -3-piperidinecarboxylic acid 1,2, 2-trimethylhydrazide SAPPHIRE THERAPEUTICS INC (US) 2007-06-06 CN claimed
CN-116096714-A Antiviral compounds for the treatment of coronavirus, picornavirus and norovirus infections 安力高医药股份有限公司 2023-05-09 CN disclosed
WO-2021134004-A1 CYCLIC COMPOUNDS AND METHODS OF USING SAME SCHRODINGER, INC. (US) 2021-07-01 WO disclosed
CN-108368084-B Biaryl kinase inhibitors 百时美施贵宝公司 2020-10-16 CN disclosed
EP-3278786-B1 DENTAL MATERIALS ON THE BASIS OF VINYLCYCLOPROPANE DERIVATIVES CONTAINING URETHANE GROUPS IVOCLAR VIVADENT AG (LI) 2019-01-23 EP disclosed
WO-2018024706-A1 DENTAL MATERIALS BASED ON VINYLCYCLOPROPANE DERIVATIVES CONTAINING URETHANE GROUPS IVOCLAR VIVADENT AG (LI) 2018-02-08 WO disclosed
CN-1976921-B Crystalline forms of (3R) -1- (2-methylalanyl-D-tryptophyl) -3- (phenylmethyl) -3-piperidinecarboxylic acid 1,2, 2-trimethylhydrazide SAPPHIRE THERAPEUTICS INC 2013-08-21 CN disclosed
CN-103025716-A Bicyclic compound derivatives and their use as acc inhibitors TAKEDA PHARMACEUTICAL 2013-04-03 CN disclosed
CN-102584937-A Crystal forms of (3r)-1-(2-methylalanyl-d-tryptophyl)-3-(phenylmethyl)-3-piperidinecarboxylic acid 1,2,2-trimethylhydrazide HELSINN THERAPEUTICS US INC 2012-07-18 CN disclosed
CN-101679397-A Quinolone and tetrahydroquinoline having NOS inhibitory activity and related compounds NEURAXON INC 2010-03-24 CN disclosed
CN-101605798-A Imidazothiazole derivative DAIICHI SANKYO CO LTD (JP) 2009-12-16 CN disclosed
CN-101466712-A Thioxanthine derivatives and their use as inhibitors of mpo ASTRAZENECA AB (SE) 2009-06-24 CN disclosed
CN-1976921-A Crystalline forms of (3R) -1- (2-methylalanyl-D-tryptophyl) -3- (phenylmethyl) -3-piperidinecarboxylic acid 1,2, 2-trimethylhydrazide SAPPHIRE THERAPEUTICS INC (US) 2007-06-06 CN disclosed
CN-1198818-C compounds with growth hormone releasing properties NOVO NORDISK AS (DK) 2005-04-27 CN disclosed
CN-1530107-A Insulin resistance treatment by growth hormone secretory hormone �Ʒ� 2004-09-22 CN disclosed
CN-1152049-C Treatment of insulin resistance with growth hormone secretagogues �Ʒ� 2004-06-02 CN disclosed
CN-1420878-A compounds with growth hormone releasing properties NOVO NORDISK AS (DK) 2003-05-28 CN disclosed