SCHEMBL3634002

SCHEMBL3634002

CCCCCOc1cccc(C(=O)N(C)C2C3CC4CC2CC(O)(C4)C3)c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.51
THRA P10827 1/20 0.51
HSD11B1 P28845 1/20 0.51
SMPD1 P17405 3/20 0.47
PLA2G4B P0C869 2/20 0.44
KMT2A Q03164 1/20 0.44
NR1H4 Q96RI1 2/20 0.43
FAAH O00519 1/20 0.42
TSHR P16473 2/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL1169240 0.84 MEN1 (0.51) HSD11B1KMT2AFAAHLMNAALDH1A1
SCHEMBL1168472 0.83 HSD11B1 (0.49) HSD11B1KMT2AFAAHALDH1A1
SCHEMBL1168079 0.82 HSD11B1 (0.45) HSD11B1NR1H4FAAH
SCHEMBL946220 0.75 HSD11B1 (0.47) HSD11B1KMT2AFAAH
SCHEMBL2830778 0.72 FAAH (0.36) HSD11B1KMT2ANR1H4FAAH
SCHEMBL944330 0.71 GPR119 (0.45) HSD11B1
SCHEMBL942960 0.71 HSD11B1 (0.47) HSD11B1FAAHLMNA
SCHEMBL3275288 0.70 NPC1 (0.46) HSD11B1KMT2ATSHRLMNAALDH1A1
SCHEMBL28019282 0.70 THRB (0.69) THRBTHRASMPD1PLA2G4BKMT2A
SCHEMBL8465014 0.70 SMPD1 (0.68) THRBTHRASMPD1PLA2G4BKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2150526-A2 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE High Point Pharmaceuticals, LLC (US) 2010-02-10 EP claimed
WO-2008101914-A2 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC (GB) 2008-08-28 WO claimed
EP-2150526-A2 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE High Point Pharmaceuticals, LLC (US) 2010-02-10 EP disclosed
WO-2008101914-A2 N-ADAMANTYL BENZAMIDES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE HIGH POINT PHARMACEUTICALS, LLC (GB) 2008-08-28 WO disclosed