SCHEMBL4784882

SCHEMBL4784882

O=S(=O)(NC1Cc2ccccc2C1)c1ccccc1C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.53
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
SLC22A12 Q96S37 8/20 0.49
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46
PSENEN Q9NZ42 1/20 0.46
SFRP1 Q8N474 2/20 0.45
WNT3 P56703 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP2C9 P11712 2/20 0.44
SLC22A6 Q4U2R8 2/20 0.44
SLC22A8 Q8TCC7 2/20 0.44
SLC22A11 Q9NSA0 2/20 0.44
KAT6A Q92794 1/20 0.43

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
SCHEMBL4732746 0.90 CA1 (0.56) NR1H2CA1CA2SLC22A12MEN1
SCHEMBL4785610 0.88 NR1H2 (0.54) NR1H2SLC22A12MEN1KMT2ASFRP1
SCHEMBL4784035 0.87 NR1H2 (0.46) NR1H2SLC22A12MEN1KMT2ASFRP1
SCHEMBL4782504 0.87 NR1H2 (0.55) NR1H2SLC22A12SFRP1WNT3CYP2C9
SCHEMBL4783738 0.87 NR1H2 (0.55) NR1H2CA1CA2SLC22A12MEN1
SCHEMBL4731532 0.85 NR1H2 (0.43) NR1H2SLC22A12MEN1KMT2ASFRP1
SCHEMBL4733742 0.84 NR1H2 (0.55) NR1H2MEN1KMT2ASFRP1WNT3
SCHEMBL4784546 0.84 NR1H2 (0.46) NR1H2CA1CA2SLC22A12MEN1
SCHEMBL4784211 0.83 NR1H2 (0.48) NR1H2SLC22A12MEN1KMT2ASFRP1
SCHEMBL4784216 0.82 NR1H2 (0.49) NR1H2SLC22A12MEN1KMT2ASFRP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008061006-A1 SUBSTITUTED INDAN-2-YL, TETRAHYDRONAPHTHALEN-2-YL, OR DIHYDR0-2H-CHR0MEN-3-YL ARYLSULFONAMIDES AND METHODS OF THEIR USE WYETH (US) 2008-05-22 WO claimed
WO-2008061006-A1 SUBSTITUTED INDAN-2-YL, TETRAHYDRONAPHTHALEN-2-YL, OR DIHYDR0-2H-CHR0MEN-3-YL ARYLSULFONAMIDES AND METHODS OF THEIR USE WYETH (US) 2008-05-22 WO disclosed