SCHEMBL9535798

SCHEMBL9535798

CC(=O)Nc1cc[c]c2c1NC(=O)CC2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
GAA P10253 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CRBN Q96SW2 8/20 0.38
DDB1 Q16531 3/20 0.38
CASP3 P42574 1/20 0.37
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35
MAOA P21397 1/20 0.33
ABL1 P00519 1/20 0.33
RIN1 Q13671 1/20 0.33
PARP14 Q460N5 1/20 0.33
ERCC1 P07992 1/20 0.32
FEN1 P39748 1/20 0.32
ERCC4 Q92889 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MAPT P10636 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
SCHEMBL11195490 0.77 ALDH1A1 (0.47) ALDH1A1HPGDKDM4EGAAHSD17B10
SCHEMBL14931570 0.73 CRBN (0.34) KDM4ECRBNNPC1
SCHEMBL12559701 0.72 ALDH1A1 (0.40) ALDH1A1HPGDKDM4EGAAHSD17B10
SCHEMBL11541698 0.72 POLB (0.41) ALDH1A1HPGDKDM4EGAAHSD17B10
SCHEMBL5539577 0.70 CRBN (0.34) ALDH1A1HPGDKDM4EGAACRBN
SCHEMBL3659895 0.69 AHR (0.50) ALDH1A1HPGDKDM4EGAAHSD17B10
SCHEMBL9382456 0.66 ALDH1A1 (0.44) ALDH1A1HPGDKDM4EGAAHSD17B10
SCHEMBL9289909 0.66 APEX1 (0.38) ALDH1A1HPGDKDM4EGAANPC1
SCHEMBL6382724 0.65 ROCK2 (0.36) ALDH1A1HPGDKDM4EGAAHSD17B10
SCHEMBL12597861 0.64 CRBN (0.38) ALDH1A1HPGDKDM4EGAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5254595-A Aryloxypropanolaminotetralins, a process for their preparation and pharmaceutical compositions containing them ELF SANOFI (FR) 1993-10-19 US disclosed
EP-0375560-B1 ARYLOXYPROPANOLAMINOTETRALINES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME ELF SANOFI (FR) 1993-05-12 EP disclosed
EP-0375560-A1 Aryloxypropanolaminotetralines, process for their preparation and pharmaceutical compositions containing same ELF SANOFI (FR) 1990-06-27 EP disclosed
EP-0200915-B1 AMINOPROPANOL DERIVATIVES, PROCESS FOR THEIR PREPARATION, THEIR USE AND MEDICINES CONTAINING THEM Roche Diagnostics GmbH (DE) 1989-09-27 EP disclosed
US-4863949-A CARDIOVASCULAR DISORDER TREATMENT BOEHRINGER MANNHEIM GMBH (DE) 1989-09-05 US disclosed
EP-0280951-A1 Amino-propanol derivatives, process for their preparation and medicines containing these compounds, as well as intermediates Roche Diagnostics GmbH (DE) 1988-09-07 EP disclosed
EP-0200915-A1 Aminopropanol derivatives, process for their preparation, their use and medicines containing them Roche Diagnostics GmbH (DE) 1986-11-12 EP disclosed