Glycine

Glycine

SCHEMBL2316017

NCC(=O)O.NS(=O)(=O)c1ccc2c(c1)CCCO2

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Glycine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 2/20 0.55
NFE2L2 Q16236 2/20 0.55
CTNNB1 P35222 7/20 0.48
WNT3A P56704 7/20 0.48
CA12 O43570 2/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA7 P43166 1/20 0.48
CA14 Q9ULX7 1/20 0.48
PKM P14618 2/20 0.43
CA9 Q16790 1/20 0.42
TRIM24 O15164 1/20 0.42
BRD1 O95696 1/20 0.42
BRPF1 P55201 1/20 0.42
KDM4E B2RXH2 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MMP2 P08253 1/20 0.39
MMP13 P45452 1/20 0.39
MAPT P10636 1/20 0.39
HDAC3 O15379 1/20 0.39

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
SCHEMBL6674134 0.89 CA2 (0.59) KEAP1NFE2L2CTNNB1WNT3ACA12
SCHEMBL968326 0.80 PKM (0.57) KEAP1NFE2L2CA12CA1CA2
SCHEMBL12365525 0.78 KDM4E (0.67) KEAP1NFE2L2CTNNB1WNT3APKM
SCHEMBL18587031 0.77 CA2 (0.59) KEAP1NFE2L2CA12CA1CA2
SCHEMBL6307961 0.77 KEAP1 (0.51) KEAP1NFE2L2CTNNB1WNT3ACA12
SCHEMBL2316022 0.77 KEAP1 (0.45) KEAP1NFE2L2CTNNB1WNT3APKM
Glycine SCHEMBL27902182 0.76 CTNNB1 (0.52) KEAP1NFE2L2CTNNB1WNT3ATDP1
SCHEMBL12596097 0.74 TRIM24 (0.51) KEAP1NFE2L2CTNNB1WNT3APKM
SCHEMBL5747283 0.74 PKM (0.49) KEAP1NFE2L2CTNNB1WNT3ACA12
SCHEMBL31396966 0.72 TSHR (0.66) KEAP1NFE2L2CTNNB1WNT3AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2536704-B1 Glycine chroman-6-sulfonamides for use as inhibitors of diacylglycerol lipase BRISTOL MYERS SQUIBB CO (US) 2014-01-15 EP disclosed
US-8404741-B2 Glycine chroman-6-sulfonamides for use as inhibitors of diacylglycerol lipase BRISTOL-MYERS SQUIBB COMPANY (US) 2013-03-26 US disclosed
US-8354548-B2 Glycine chroman-6-sulfonamides for use as inhibitors of diacylglycerol lipase BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-15 US disclosed
CN-102858753-A Glycine chroman-6-sulfonamides for use as inhibitors of diacylglycerol lipase BRISTOL MYERS SQUIBB CO 2013-01-02 CN disclosed
CN-102858760-A Glycine chroman-6-sulfonamides for use as inhibitors of diacylglycerol lipase BRISTOL MYERS SQUIBB CO 2013-01-02 CN disclosed
EP-2536704-A1 GLYCINE CHROMAN-6-SULFONAMIDES FOR USE AS INHIBITORS OF DIACYLGLYCEROL LIPASE Bristol-Myers Squibb Company (US) 2012-12-26 EP disclosed
EP-2536704-A1 GLYCINE CHROMAN-6-SULFONAMIDES FOR USE AS INHIBITORS OF DIACYLGLYCEROL LIPASE Bristol-Myers Squibb Company (US) 2012-12-26 EP disclosed
US-20110207749-A1 Glycine Chroman-6-Sulfonamides for Use as Inhibitors of Diacylglycerol Lipase BRISTOL-MYERS SQUIBB COMPANY 2011-08-25 US disclosed
WO-2011103156-A1 GLYCINE CHROMAN-6-SULFONAMIDES FOR USE AS INHIBITORS OF DIACYLGLYCEROL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2011-08-25 WO disclosed
WO-2011103156-A1 GLYCINE CHROMAN-6-SULFONAMIDES FOR USE AS INHIBITORS OF DIACYLGLYCEROL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2011-08-25 WO disclosed
US-20110207772-A1 Glycine Chroman-6-Sulfonamides for Use as Inhibitors of Diacylglycerol Lipase BRISTOL-MYERS SQUIBB COMPANY 2011-08-25 US 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 (2 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-20110207749-A1 Glycine Chroman-6-Sulfonamides for Use as Inhibitors of Diacylglycerol Lipase DAGLB, DAGLA, MGLL KEAP1 2888/4885NFE2L2 4799/4885CTNNB1 2916/4885
US-20110207772-A1 Glycine Chroman-6-Sulfonamides for Use as Inhibitors of Diacylglycerol Lipase DAGLB, DAGLA, MGLL KEAP1 2888/4885NFE2L2 4799/4885CTNNB1 2916/4885

“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.