SCHEMBL11512072

SCHEMBL11512072

O=C1CCCCC1Oc1ccccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.43
MAOB P27338 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HTR2A P28223 4/20 0.42
HTR2C P28335 4/20 0.42
HTR2B P41595 4/20 0.42
CA1 P00915 2/20 0.41
MAPT P10636 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 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
SCHEMBL11509191 0.81 MAOA (0.52) MAOAMAOBSLC6A4SLC6A2SLC6A3
SCHEMBL7875349 0.81 MAOA (0.43) MAOAMAOBMAPTMEN1KMT2A
SCHEMBL6825651 0.81 MAOA (0.51) MAOAMAOBSLC6A4SLC6A2CA1
SCHEMBL11509987 0.81 MAOA (0.43) MAOAMAOBSLC6A2SLC6A3MAPT
SCHEMBL5593661 0.81 MAOA (0.43) MAOAMAOBMAPTMEN1KMT2A
SCHEMBL14398424 0.77 MCL1 (0.45) MAOAMAOBMAPTMEN1KMT2A
SCHEMBL148639 0.76 MAOA (0.52) MAOAMAOBMAPTKMT2AKDM4E
SCHEMBL5785711 0.75 MAOA (0.52) MAOAMAOBSLC6A4SLC6A2CA1
SCHEMBL6822940 0.75 MAOA (0.42) MAOAMAOBMAPTMEN1KMT2A
SCHEMBL9501603 0.74 PTGS2 (0.43) MAOAMAOBMAPTMEN1KMT2A

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
US-RE29902-E 6-Aryloxy-2-oxo-1-aza-4-oxo (or thia)-spiro[4,5]decanes as CNS stimulants CENTRE EUROPEEN DE RECHERCHES MAUVERNAY (FR) 1979-02-06 US disclosed
US-4086352-A CNS STIMULANTS CENTRE EUROPEEN DE RECHERCHES MAUVERNAY (FR) 1978-04-25 US disclosed
US-4000292-A CNS STIMULATORS CENTRE EUROPEEN DE RECHERCHES MAUVERNAR (FR) 1976-12-28 US disclosed