SCHEMBL5315648

SCHEMBL5315648

O=C(NC1C2CC3CC(C2)CC1C3)[C@H]1CCCN1S(=O)(=O)c1ccccc1Cl

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 9/20 0.61
FAAH O00519 2/20 0.47
ITGB1 P05556 7/20 0.47
ITGA4 P13612 7/20 0.47
ITGB7 P26010 1/20 0.47
KCNQ1 P51787 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL14529760 1.00 HSD11B1 (0.61) HSD11B1FAAHITGB1ITGA4ITGB7
SCHEMBL5332784 0.85 HSD11B1 (0.49) HSD11B1FAAH
SCHEMBL5316746 0.85 ITGB1 (0.50) HSD11B1ITGB1ITGA4ITGB7
SCHEMBL5311431 0.84 HSD11B1 (0.51) HSD11B1ITGB1ITGA4ITGB7
SCHEMBL14529619 0.83 HSD11B1 (0.54) HSD11B1FAAHITGB1ITGA4ITGB7
SCHEMBL14530354 0.83 HSD11B1 (0.54) HSD11B1FAAHITGB1ITGA4ITGB7
SCHEMBL12640491 0.82 HCRTR1 (0.57) HSD11B1ITGB1ITGA4ITGB7
SCHEMBL3727147 0.77 MMP8 (0.58) HSD11B1FAAH
SCHEMBL14529605 0.77 ITGB1 (0.53) HSD11B1ITGB1ITGA4ITGB7L3MBTL1
SCHEMBL14530359 0.76 HSD11B1 (0.52) HSD11B1FAAHKCNQ1L3MBTL1

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-2007057768-A2 SULFONYL DERIVATIVES PFIZER PRODUCTS INC. (US) 2007-05-24 WO disclosed