SCHEMBL8868917

SCHEMBL8868917

NS(=O)(=O)c1ccc(S(=O)(=O)NCc2ccc(F)cc2)s1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 7/20 0.61
CA2 P00918 7/20 0.61
CA9 Q16790 5/20 0.61
CA12 O43570 4/20 0.54
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
NSD2 O96028 2/20 0.48
LMNA P02545 2/20 0.47
GALR3 O60755 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CA4 P22748 2/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
CYP19A1 P11511 1/20 0.44
KDM4E B2RXH2 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
SCHEMBL8870068 0.84 CA2 (0.56) CA1CA2CA9CA12KMT2A
SCHEMBL22460148 0.82 CYP1A2 (0.59) CA1CA2CA9MEN1KMT2A
SCHEMBL680127 0.81 CA12 (0.56) CA1CA2CA9CA12NSD2
SCHEMBL8870101 0.78 GUSB (0.48) CA1CA2CA9CA12LMNA
SCHEMBL8869848 0.78 CYP1A2 (0.45) CA1CA2CA9CA12MEN1
SCHEMBL14380636 0.75 CA2 (0.66) CA1CA2CA9CA12MEN1
SCHEMBL5000718 0.73 MAPT (0.43) CA1CA2CA9MEN1KMT2A
SCHEMBL677620 0.72 ALDH1A1 (0.50) MEN1KMT2ANSD2LMNA
SCHEMBL22388775 0.70 CA1 (0.71) CA1CA2CA9KMT2ANSD2
SCHEMBL20946426 0.70 CA1 (0.77) CA1CA2CA9CA12MEN1

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
US-5679670-A CONTROLLING INTRAOCULAR PRESSURE ALCON LABORATORIES, INC. (US) 1997-10-21 US disclosed
US-5378703-A FOR CONTROLLING INTRAOCULAR PRESSURE ALCON LABORATORIES, INC. (US) 1995-01-03 US disclosed