SCHEMBL3630902

SCHEMBL3630902

CC(C)(C)C(OC(N)=O)C1CNC1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
ATM Q13315 1/20 0.32
CSNK2A2 P19784 1/20 0.31
CSNK2A1 P68400 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 SCHEMBL31255580 0.98 LMNA (0.32) LMNAHSD17B10SLC6A4SLC6A3ATM
SCHEMBL19063653 0.88 KDM4E (0.33) SLC6A4SLC6A3ATMCSNK2A2CSNK2A1
SCHEMBL17076623 0.84 ALOX5 (0.35) LMNAHSD17B10ATMCSNK2A2CSNK2A1
SCHEMBL3619346 0.84 SSTR4 (0.30) LMNAHSD17B10
SCHEMBL1711675 0.84 CPN1 (0.35) LMNAHSD17B10SLC6A4SLC6A3CSNK2A2
SCHEMBL29560810 0.78 CHRNB2 (0.34) HSD17B10SLC6A4SLC6A3
SCHEMBL28722096 0.75 CSNK2A2 (0.37) ATMCSNK2A2CSNK2A1
SCHEMBL3465229 0.74 SLC6A2 (0.36) SLC6A4SLC6A3
SCHEMBL29239448 0.74
SCHEMBL16338060 0.74 ALOX5 (0.33) CSNK2A2CSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110896634-A 2- (4-chlorophenoxy) -N- ((1- (2- (4-chlorophenoxy) ethynylazetidin-3-yl) methyl) acetamide derivatives and related compounds as ATF4 inhibitors for the treatment of cancer and other diseases 葛兰素史密斯克莱知识产权发展有限公司 2020-03-20 CN disclosed
EP-2144910-A2 OXAZOLIDINONE ANTIBIOTICS Actelion Pharmaceuticals Ltd. (CH) 2010-01-20 EP disclosed
WO-2008126034-A2 OXAZOLIDINONE ANTIBIOTICS ACTELION PHARMACEUTICALS LTD (CH) 2008-10-23 WO disclosed