SCHEMBL7635924

SCHEMBL7635924

Cc1ccc(S(=O)(=O)NC2c3ccccc3C=C[C@@H]2OC(=O)C(C)(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.42
PSEN1 P49768 2/20 0.41
PSEN2 P49810 2/20 0.41
APH1B Q8WW43 2/20 0.41
NCSTN Q92542 2/20 0.41
APH1A Q96BI3 2/20 0.41
PSENEN Q9NZ42 2/20 0.41
ALDH1A1 P00352 6/20 0.39
MAPT P10636 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
REN P00797 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL13998299 1.00 FFAR4 (0.42) FFAR4PSEN1PSEN2APH1BNCSTN
SCHEMBL4862242 1.00 FFAR4 (0.42) FFAR4PSEN1PSEN2APH1BNCSTN
SCHEMBL4862250 1.00 FFAR4 (0.42) FFAR4PSEN1PSEN2APH1BNCSTN
SCHEMBL4862234 1.00 FFAR4 (0.42) FFAR4PSEN1PSEN2APH1BNCSTN
SCHEMBL13998297 0.89 FFAR4 (0.43) FFAR4PSEN1PSEN2APH1BNCSTN
SCHEMBL4855679 0.89 FFAR4 (0.43) FFAR4PSEN1PSEN2APH1BNCSTN
SCHEMBL4855742 0.86 FFAR4 (0.41) FFAR4PSEN1PSEN2APH1BNCSTN
SCHEMBL4852882 0.86 FFAR4 (0.41) FFAR4PSEN1PSEN2APH1BNCSTN
SCHEMBL4852878 0.86 FFAR4 (0.41) FFAR4PSEN1PSEN2APH1BNCSTN
SCHEMBL13998298 0.86 FFAR4 (0.41) FFAR4PSEN1PSEN2APH1BNCSTN

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
EP-1228024-A1 NOVEL HYDRONAPHTALENE COMPOUNDS, PREPARED BY A RHODIUM CATALYZED RING OPENING REACTION IN THE PRESENCE OF PHOSPHINE LIGAND AstraZeneca AB (SE) 2002-08-07 EP claimed
WO-2001030734-A1 NOVEL HYDRONAPHTALENE COMPOUNDS, PREPARED BY A RHODIUM CATALYZED RING OPENING REACTION IN THE PRESENCE OF PHOSPHINE LIGAND ASTRAZENECA AB (SE) 2001-05-03 WO claimed