SCHEMBL4011653

SCHEMBL4011653

Cc1c(Cl)cccc1S(=O)(=O)[C@@]1(NC(=O)C(C)(C)C)CCCNC1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 17/20 0.38
HDAC4 P56524 1/20 0.36
ITGB1 P05556 1/20 0.33
ITGA4 P13612 1/20 0.33
ITGB7 P26010 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL4010548 0.90 HSD11B1 (0.38) HSD11B1HDAC4ITGB1ITGA4ITGB7
SCHEMBL4006571 0.85 HSD11B1 (0.43) HSD11B1LMNA
SCHEMBL4009205 0.85 ITGB1 (0.38) HSD11B1HDAC4ITGB1ITGA4ITGB7
SCHEMBL4005617 0.85 ITGB1 (0.36) HSD11B1HDAC4ITGB1ITGA4ITGB7
SCHEMBL4010678 0.85 HSD11B1 (0.45) HSD11B1LMNA
SCHEMBL4005449 0.84 ITGB1 (0.37) HSD11B1HDAC4ITGB1ITGA4ITGB7
SCHEMBL4010758 0.84 ALDH1A1 (0.37) HSD11B1ITGB1ITGA4ITGB7POLB
SCHEMBL4003450 0.84 HCRTR1 (0.36) HSD11B1ITGB1ITGA4ITGB7
SCHEMBL4003349 0.83 HSD11B1 (0.45) HSD11B1LMNA
SCHEMBL3999745 0.83 FPR2 (0.39) HSD11B1ITGB1ITGA4ITGB7LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778229-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-06-17 EP claimed
EP-1778229-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-05-02 EP claimed
WO-2006020598-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-23 WO claimed
EP-1778229-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-06-17 EP disclosed
EP-1778229-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-05-02 EP disclosed
WO-2006020598-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-23 WO disclosed