SCHEMBL9451229

SCHEMBL9451229

CNS(=O)(=O)OCCOc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 2/20 0.52
HTR1D P28221 1/20 0.52
RAB9A P51151 2/20 0.47
MAPT P10636 1/20 0.47
PKM P14618 2/20 0.47
KCNA3 P22001 1/20 0.47
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45
MEN1 O00255 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
NPC1 O15118 1/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL9490849 0.83 KMT2A (0.46) RAB9AMEN1KMT2AL3MBTL1DRD2
SCHEMBL24360927 0.83 MEN1 (0.49) HTR1BHTR1DRAB9AMAPTPKM
SCHEMBL28779160 0.81 RAB9A (0.49) HTR1BHTR1DRAB9AMAPTPKM
SCHEMBL7976554 0.79 KCNA3 (0.52) HTR1BHTR1DRAB9AMAPTPKM
SCHEMBL1607270 0.79 KCNA3 (0.56) HTR1BHTR1DRAB9AMAPTPKM
SCHEMBL12798632 0.76 PKM (0.49) HTR1BHTR1DRAB9AMAPTPKM
SCHEMBL10153743 0.76 HTR1B (0.53) HTR1BHTR1DRAB9AMAPTPKM
SCHEMBL18195896 0.76 KCNA3 (0.40) HTR1BHTR1DRAB9AMAPTPKM
SCHEMBL1253674 0.76 PKM (0.53) RAB9AMAPTPKMKCNA3MTNR1A
SCHEMBL9451235 0.76 CA1 (0.58) KCNA3TAAR1PARP10

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-5273993-A Antiarthritic agents; osteoporosis A. H. ROBINS COMPANY, INCORPORATED (US) 1993-12-28 US disclosed
US-5194446-A Antiarthritic agents A. H. ROBINS COMPANY, INCORPORATED (US) 1993-03-16 US disclosed
US-5025031-A Aryl and aryloxyalkyl sulfamate esters useful as anticonvulsants A. H. ROBINS CO., INC. (US) 1991-06-18 US disclosed