SCHEMBL506649

SCHEMBL506649

CC(C)(C)OC(=O)NCCOCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.62
SMN1; SMN2 Q16637 2/20 0.61
LMNA P02545 1/20 0.61
PPARA Q07869 2/20 0.56
HTT P42858 1/20 0.56
SYK P43405 1/20 0.53
CTSS P25774 1/20 0.53
PPARG P37231 1/20 0.51
L3MBTL1 Q9Y468 3/20 0.50
BCHE P06276 1/20 0.49
CNR2 P34972 1/20 0.49
CA12 O43570 2/20 0.48
CA1 P00915 2/20 0.48
CA7 P43166 1/20 0.48
CA14 Q9ULX7 1/20 0.48
SIGMAR1 Q99720 2/20 0.47
MAPT P10636 2/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
ASAH1 Q13510 1/20 0.46

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
SCHEMBL30316999 0.95 SMN1; SMN2 (0.59) IDO1SMN1; SMN2LMNAPPARAHTT
SCHEMBL29456998 0.93 SMN1; SMN2 (0.58) IDO1SMN1; SMN2LMNAPPARAHTT
SCHEMBL29612740 0.93 SMN1; SMN2 (0.58) IDO1SMN1; SMN2LMNAPPARAHTT
SCHEMBL21070510 0.92 SMN1; SMN2 (0.64) IDO1SMN1; SMN2LMNAPPARAHTT
SCHEMBL13622021 0.92 IDO1 (0.56) IDO1SMN1; SMN2LMNAPPARAHTT
SCHEMBL20196937 0.89 L3MBTL1 (0.58) IDO1SMN1; SMN2LMNAPPARASYK
SCHEMBL12196470 0.89 SMN1; SMN2 (0.76) IDO1SMN1; SMN2LMNAPPARAHTT
SCHEMBL23657108 0.88 PPARA (0.55) IDO1SMN1; SMN2LMNAPPARAHTT
SCHEMBL30958390 0.88 IDO1 (0.51) IDO1SMN1; SMN2LMNAPPARAHTT
SCHEMBL21070508 0.88 SMN1; SMN2 (0.52) IDO1SMN1; SMN2LMNAPPARAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022272106-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2022-12-29 WO disclosed
WO-2021102288-A1 PYRIDOPYRIMIDINONE DERIVATIVES AS AHR ANTAGONISTS SENDA BIOSCIENCES, INC. (US) 2021-05-27 WO disclosed
EP-2842939-B1 BENZAMIDE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-05-30 EP disclosed
US-9593113-B2 Imide and acylurea derivatives as modulators of the glucocorticoid receptor BRISTOL-MYERS SQUIBB COMPANY (US) 2017-03-14 US disclosed
US-20160185776-A1 IMIDE AND ACYLUREA DERIVATIVES AS MODULATORS OF THE GLUCOCORTICOID RECEPTOR BRISTOL-MYERS SQUIBB COMPANY (US) 2016-06-30 US disclosed
EP-1720836-B1 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO [D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS LILLY CO ELI (US) 2014-04-16 EP disclosed
US-8580780-B2 6 substituted 2, 3,4,5 tetrahydro-1H-benzo[d]azepines as 5-HT2C receptor agonist ELI LILLY AND COMPANY (US) 2013-11-12 US disclosed
EP-2479168-A1 6-Substituted 2,3,4,5-Tetrahydro-1H-Benzo [d]Azepines as 5-HT2C Receptor Agonists ELI LILLY AND COMPANY (US) 2012-07-25 EP disclosed
US-20120028961-A1 6 Substituted 2, 3,4,5 Tetrahydro-1H-Benzo[d]Azepines as 5-HT2c Receptor Agonist ELI LILLY AND COMPANY (US) 2012-02-02 US disclosed
US-8022062-B2 6-substituted 2,3,4,5-tetrahydro-1H-benzo[d]azepines as 5-HT2C receptor agonists ELI LILLY AND COMPANY (US) 2011-09-20 US disclosed
EP-1720836-A1 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO [D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2006-11-15 EP disclosed
US-20060252792-A1 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2006-11-09 US disclosed
US-7125890-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-10-24 US disclosed
WO-2006064277-A1 SILICON COMPOUNDS AND THEIR USE TAKEDA CAMBRIDGE LIMITED (GB) 2006-06-22 WO disclosed
WO-2005082859-A1 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2005-09-09 WO disclosed
EP-1513524-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2005-03-16 EP disclosed
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors 3M INNOVATIVE PROPERTIES COMPANY 2005-02-10 US disclosed
US-6797718-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-09-28 US disclosed
US-20040010007-A1 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-01-15 US disclosed
WO-2003103584-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-12-18 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 (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-20060252792-A1 ETHER SUBSTITUTED IMIDAZOPYRIDINES IL2, IL4, MYD88 IDO1 233/4885SMN1; SMN2 2887/4885LMNA 4400/4885
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors IL2, IFNG, TSLP IDO1 134/4885SMN1; SMN2 4130/4885LMNA 4818/4885
US-20040010007-A1 Ether substituted imidazopyridines IL2, IL4, MYD88 IDO1 233/4885SMN1; SMN2 2887/4885LMNA 4400/4885
US-20160185776-A1 IMIDE AND ACYLUREA DERIVATIVES AS MODULATORS OF THE GLUCOCORTICOID RECEPTOR NFKBIA, IKBKB, NFRKB IDO1 1537/4885SMN1; SMN2 2765/4885LMNA 4571/4885
US-20120028961-A1 6 Substituted 2, 3,4,5 Tetrahydro-1H-Benzo[d]Azepines as 5-HT2c Receptor Agonist HTR2C, HTR4, HTR1A IDO1 391/4885SMN1; SMN2 2954/4885LMNA 4672/4885

“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.