SCHEMBL3663469

SCHEMBL3663469

Cc1ccc(-c2oncc2C(=O)N2CCC[C@H](C(C)(C)O)C2I)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 17/20 0.41
HCRTR1 O43613 16/20 0.41

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
SCHEMBL3661305 1.00 HCRTR2 (0.41) HCRTR2HCRTR1
SCHEMBL3663295 0.89 HCRTR1 (0.39) HCRTR2HCRTR1
SCHEMBL3663775 0.89 HCRTR1 (0.39) HCRTR2HCRTR1
SCHEMBL3665234 0.86 HCRTR2 (0.39) HCRTR2HCRTR1
SCHEMBL3661558 0.86 HCRTR2 (0.39) HCRTR2HCRTR1
SCHEMBL3664407 0.84 HCRTR2 (0.41) HCRTR2HCRTR1
SCHEMBL3666816 0.84 HCRTR2 (0.41) HCRTR2HCRTR1
SCHEMBL3663234 0.83 HCRTR2 (0.41) HCRTR2HCRTR1
SCHEMBL3665517 0.83 HCRTR2 (0.41) HCRTR2HCRTR1
SCHEMBL3664194 0.82 HCRTR1 (0.39) HCRTR2HCRTR1

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-2231650-A1 ISOXAZOLE DERIVATIVES AS MODULATORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 Biovitrum AB (publ) (SE) 2010-09-29 EP claimed
WO-2009090239-A1 ISOXAZOLE DERIVATIVES AS MODULATORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (PUBL) (SE) 2009-07-23 WO claimed
EP-2231650-A1 ISOXAZOLE DERIVATIVES AS MODULATORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 Biovitrum AB (publ) (SE) 2010-09-29 EP disclosed
WO-2009090239-A1 ISOXAZOLE DERIVATIVES AS MODULATORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (PUBL) (SE) 2009-07-23 WO disclosed