SCHEMBL10690261

SCHEMBL10690261

[O]c1cccc2c1CC(NS(=O)(=O)c1ccccc1)CC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 1/20 0.49
PSEN2 P49810 1/20 0.49
APH1B Q8WW43 1/20 0.49
NCSTN Q92542 1/20 0.49
APH1A Q96BI3 1/20 0.49
PSENEN Q9NZ42 1/20 0.49
TBXA2R P21731 4/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
HTR6 P50406 3/20 0.44
PNMT P11086 1/20 0.42
RB1 P06400 1/20 0.42
HDAC8 Q9BY41 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
MCOLN2 Q8IZK6 1/20 0.41
MCOLN3 Q8TDD5 1/20 0.41
MCOLN1 Q9GZU1 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL10694135 0.89 TBXA2R (0.56) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10357320 0.85 CA1 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10357304 0.83 MTNR1A (0.60) CA1CA2MEN1KMT2ADRD2
SCHEMBL10465600 0.82 TBXA2R (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10358272 0.78 TBXA2R (0.50) TBXA2RPTGDRPTGDR2
SCHEMBL10694138 0.77 CA1 (0.65) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10464736 0.76 TBXA2R (0.44) TBXA2RMEN1LMNAKMT2APTGDR
SCHEMBL10686827 0.76 CA1 (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9832398 0.75 PSEN1 (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10691886 0.75 PSEN1 (0.48) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0253257-A2 Substituted amino-5,6,7,8-tetrahydronaphthyl-oxyacetic acids, method for their preparation and their application as medicaments BAYER AG (DE) 1988-01-20 EP disclosed