SCHEMBL4005451

SCHEMBL4005451

Cc1c(Cl)cccc1S(=O)(=O)N1CCCC(NC(=O)C(c2ccccc2)c2ccccc2)C1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 10/20 0.65
RAB9A P51151 1/20 0.46
USP2 O75604 1/20 0.46
MAPK1 P28482 1/20 0.46
EPHX2 P34913 1/20 0.45
AKR1C3 P42330 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL4005445 1.00 HSD11B1 (0.65) HSD11B1RAB9AUSP2MAPK1EPHX2
SCHEMBL4138538 0.88 HSD11B1 (0.70) HSD11B1RAB9AMAPK1EPHX2ALDH1A1
SCHEMBL612467 0.88 HSD11B1 (0.75) HSD11B1RAB9AUSP2MAPK1EPHX2
SCHEMBL4010554 0.88 HSD11B1 (0.75) HSD11B1RAB9AUSP2MAPK1EPHX2
SCHEMBL27707777 0.86 HSD11B1 (0.48) HSD11B1RAB9AUSP2MAPK1EPHX2
SCHEMBL4009206 0.85 HSD11B1 (0.68) HSD11B1ALDH1A1
SCHEMBL4009203 0.85 HSD11B1 (0.68) HSD11B1ALDH1A1
SCHEMBL4142798 0.84 HSD11B1 (0.90) HSD11B1RAB9AEPHX2ALDH1A1TP53
SCHEMBL4005619 0.83 HSD11B1 (0.68) HSD11B1RAB9AEPHX2
SCHEMBL4005615 0.83 HSD11B1 (0.68) HSD11B1RAB9AEPHX2

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 3 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