SCHEMBL10691886

SCHEMBL10691886

O=S(=O)(NC1CCc2ccc[c]c2C1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 1/20 0.48
PSEN2 P49810 1/20 0.48
APH1B Q8WW43 1/20 0.48
NCSTN Q92542 1/20 0.48
APH1A Q96BI3 1/20 0.48
PSENEN Q9NZ42 1/20 0.48
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
TBXA2R P21731 2/20 0.42
PNMT P11086 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
MMP13 P45452 1/20 0.42
MMP14 P50281 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.41
ALDH1A1 P00352 3/20 0.41
LMNA P02545 3/20 0.41
GAA P10253 3/20 0.41
TSHR P16473 3/20 0.41
HTT P42858 3/20 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
SCHEMBL10357320 0.76 CA1 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10686827 0.75 CA1 (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10690261 0.75 PSEN1 (0.49) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9832398 0.74 PSEN1 (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5822058 0.73 PSEN1 (0.65) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10694135 0.72 TBXA2R (0.56) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10357304 0.72 MTNR1A (0.60) CA1CA2MEN1KMT2AMAPT
SCHEMBL8384541 0.71 PSEN1 (0.64) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10686831 0.71 CA1 (0.63) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10694138 0.71 CA1 (0.65) 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