SCHEMBL5571276

SCHEMBL5571276

O=C1N([C@H]2CC[C@H](O)CC2)CC[C@@]12CCCN(C1=CC[CH]C=C1)C2

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 9/20 0.38

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
SCHEMBL5572536 1.00 HSD11B1 (0.38) HSD11B1
SCHEMBL5571631 0.88 HSD11B1 (0.39) HSD11B1
SCHEMBL5572047 0.78 HSD11B1 (0.35) HSD11B1
SCHEMBL5567762 0.78 HSD11B1 (0.35) HSD11B1
SCHEMBL5571996 0.78 HSD11B1 (0.35) HSD11B1
SCHEMBL5569263 0.78 HSD11B1 (0.39) HSD11B1
SCHEMBL5570144 0.76 HSD11B1 (0.33) HSD11B1
SCHEMBL550322 0.75 CYP3A4 (0.41) HSD11B1
SCHEMBL550321 0.75 CYP3A4 (0.41) HSD11B1
SCHEMBL2700526 0.74 CYP2D6 (0.43) HSD11B1

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-1812005-A2 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-08-01 EP claimed
WO-2006053024-A2 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-05-18 WO claimed