SCHEMBL5573022

SCHEMBL5573022

O=C1N([C@H]2CC[C@H](O)CC2)CC[C@@]12CCCN(c1cc[c]cc1F)C2

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.39
HRH3 Q9Y5N1 4/20 0.31
SCN9A Q15858 1/20 0.31

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
SCHEMBL17074576 1.00 HSD11B1 (0.39) HSD11B1HRH3SCN9A
SCHEMBL17074575 1.00 HSD11B1 (0.39) HSD11B1HRH3SCN9A
SCHEMBL5573026 1.00 HSD11B1 (0.39) HSD11B1HRH3SCN9A
SCHEMBL5572384 0.89 HSD11B1 (0.39) HSD11B1HRH3
SCHEMBL5573058 0.88 HSD11B1 (0.39) HSD11B1HRH3
SCHEMBL5573065 0.88 HSD11B1 (0.39) HSD11B1HRH3
SCHEMBL550117 0.85 SCN9A (0.43) HSD11B1SCN9A
SCHEMBL550118 0.85 SCN9A (0.43) HSD11B1SCN9A
SCHEMBL549672 0.85 SCN9A (0.43) HSD11B1SCN9A
SCHEMBL2699529 0.85 SCN9A (0.43) HSD11B1SCN9A

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 disclosed
WO-2006053024-A2 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-05-18 WO disclosed