SCHEMBL8353563

SCHEMBL8353563

NS(=O)(=O)c1ccc2c(c1)C=CCC2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 15/20 0.51
CA1 P00915 14/20 0.51
CA12 O43570 10/20 0.51
CA7 P43166 7/20 0.51
CA14 Q9ULX7 7/20 0.51
CA9 Q16790 11/20 0.45
PNMT P11086 2/20 0.45
ADRA2A P08913 1/20 0.45
ADRA2B P18089 1/20 0.45
ADRA2C P18825 1/20 0.45
CA4 P22748 4/20 0.38
CA6 P23280 4/20 0.38
CA5A P35218 4/20 0.38
CA5B Q9Y2D0 4/20 0.38
LMNA P02545 1/20 0.38
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL17733550 0.83 PNMT (0.45) PNMTLMNA
SCHEMBL30232448 0.82 CA2 (0.50) CA2CA1CA12CA7CA14
SCHEMBL4239331 0.82 CA2 (0.50) CA2CA1CA12CA7CA14
SCHEMBL27675520 0.81 CA2 (0.49) CA2CA1CA12CA7CA14
SCHEMBL31503035 0.72 CA9 (0.35) CA2CA1CA12CA9LMNA
SCHEMBL7650098 0.72 CA9 (0.35) CA2CA1CA12CA9LMNA
SCHEMBL7993133 0.71 CA2 (0.50) CA2CA1CA12CA7CA14
SCHEMBL30232426 0.71 CA1 (0.46) CA2CA1CA12CA7CA14
SCHEMBL27678135 0.71 CA1 (0.50) CA2CA1CA12CA7CA14
SCHEMBL28305387 0.70 CA2 (0.37) CA2CA1CA12CA7CA14

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
WO-2003051370-A1 SELECTIVE DOPAMINE D3 RECEPTOR AGONISTS FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER LIMITED (GB) 2003-06-26 WO disclosed