SCHEMBL11276509

SCHEMBL11276509

O=C(O)NC1CCc2c([nH]c3ccccc23)C1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RB1 P06400 8/20 0.65
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
MAPK1 P28482 1/20 0.47
CASP1 P29466 1/20 0.47
ATM Q13315 1/20 0.47
HSD17B10 Q99714 1/20 0.47
USP30 Q70CQ3 1/20 0.47
SIRT1 Q96EB6 1/20 0.46
NR2E1 Q9Y466 2/20 0.46
HTR5A P47898 1/20 0.46
NISCH Q9Y2I1 1/20 0.46
DRD2 P14416 1/20 0.45
DRD1 P21728 1/20 0.45
DRD5 P21918 1/20 0.45

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
SCHEMBL14693721 0.89 NR2E1 (0.56) RB1KDM4EALDH1A1MAPTMAPK1
SCHEMBL11284150 0.88 RB1 (0.64) RB1KDM4EALDH1A1MAPTMAPK1
SCHEMBL11275075 0.85 RB1 (0.60) RB1MAPT
SCHEMBL29991881 0.83 RB1 (0.58) RB1KDM4EALDH1A1MAPTHSD17B10
SCHEMBL29991670 0.83 RB1 (0.58) RB1KDM4EALDH1A1MAPTHSD17B10
SCHEMBL29991664 0.83 RB1 (0.58) RB1KDM4EALDH1A1MAPTHSD17B10
SCHEMBL5520186 0.81 RB1 (0.67) RB1KDM4ENR2E1HTR5ANISCH
SCHEMBL11283856 0.80 RB1 (0.70) RB1KDM4ENR2E1DRD2DRD1
SCHEMBL11286535 0.80 RB1 (0.69) RB1KDM4ENR2E1HTR5ANISCH
SCHEMBL4282646 0.79 RB1 (0.53) RB1KDM4ESIRT1NR2E1HTR5A

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
US-4343812-A Antidepressant 2-amino-and-2-(substituted amino)-cis-hexahydro-carbazoles, compositions and use E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-08-10 US disclosed
EP-0004342-B1 CARBAZOLES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND INTERMEDIATES THERETO E.I. DU PONT DE NEMOURS AND COMPANY (US) 1981-07-15 EP disclosed
US-4254134-A Antidepressant 2-amino- and -2-(substituted amino)-cis-hexahydro-carbazoles ENDO LABORATORIES, INC. (US) 1981-03-03 US disclosed
EP-0004342-A1 Carbazoles, process for their preparation, pharmaceutical compositions containing them, and intermediates thereto E.I. DU PONT DE NEMOURS AND COMPANY (US) 1979-10-03 EP disclosed