SCHEMBL1724699

SCHEMBL1724699

CC(CC(N)=O)CN(C)C

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.33
▸ CHRNB2 P17787 1/20 0.32
▸ CHRNB4 P30926 1/20 0.32
▸ CHRNA3 P32297 1/20 0.32
▸ CHRNA4 P43681 1/20 0.32
▸ ECE1 P42892 2/20 0.32
▸ TDP1 Q9NUW8 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
SCHEMBL3392036 0.79 ALDH1A1 (0.38) ECE1TDP1
SCHEMBL22206877 0.78 SLC22A6 (0.38) GAATDP1
SCHEMBL28240410 0.77 ALOX15 (0.40) GAACHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL23771194 0.76 CHRNB2 (0.38) GAACHRNB2CHRNB4CHRNA4
SCHEMBL12189857 0.76 LMNA (0.33) TDP1
SCHEMBL15946666 0.76 GAA (0.33) GAA
SCHEMBL14655206 0.74 CHRNB2 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4ECE1
SCHEMBL3477951 0.74 CHRNB2 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4ECE1
SCHEMBL14166969 0.74 CHRNB2 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4ECE1
SCHEMBL27917872 0.74 USP2 (0.37) CHRNB2CHRNB4CHRNA3CHRNA4TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3649106-A1 N-(3-(2-(4-CHLOROPHENOXY)ACETAMIDO)BICYCLO[1.1.1]PENTAN-1-YL)-2-CYCLOBUTANE-1-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ATF4 INHIBITORS FOR TREATING CANCER AND OTHER DISEASES GlaxoSmithKline Intellectual Property Development Limited (GB) 2020-05-13 — — EP claimed
WO-2019008506-A1 N-(3-(2-(4-CHLOROPHENOXY)ACETAMIDO)BICYCLO[1.1.1]PENTAN-1-YL)-2-CYCLOBUTANE-1-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ATF4 INHIBITORS FOR TREATING CANCER AND OTHER DISEASES GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-10 — — WO claimed
EP-2403856-A1 METHYLENEDIOXYBENZO [I]PHENANTHRIDINE DERIVATIVES USED TO TREAT CANCER Rutgers, The State University of New Jersey (US) 2012-01-11 — — EP claimed
WO-2010102219-A1 METHYLENEDIOXYBENZO [I] PHENANTHRIDINE DERIVATIVES USED TO TREAT CANCER RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2010-09-10 — — WO claimed
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