SCHEMBL28067782

SCHEMBL28067782

CC(CBr)C(=O)NC1C2CC3CC1CC(O)(C3)C2

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 18/20 0.54
EPHX2 P34913 2/20 0.53
HSD11B2 P80365 4/20 0.47

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
SCHEMBL232571 0.84 HSD11B1 (0.57) HSD11B1EPHX2HSD11B2
SCHEMBL230322 0.84 HSD11B1 (0.57) HSD11B1EPHX2HSD11B2
SCHEMBL12308304 0.83 HSD11B1 (0.60) HSD11B1EPHX2HSD11B2
SCHEMBL6325458 0.81 HSD11B1 (0.57) HSD11B1EPHX2HSD11B2
SCHEMBL12334440 0.75 HSD11B1 (0.56) HSD11B1EPHX2HSD11B2
SCHEMBL257525 0.75 HSD11B1 (0.56) HSD11B1EPHX2HSD11B2
SCHEMBL231998 0.74 HSD11B1 (0.70) HSD11B1EPHX2HSD11B2
SCHEMBL17350282 0.73 HSD11B1 (0.54) HSD11B1EPHX2HSD11B2
SCHEMBL3041989 0.73 HSD11B1 (0.54) HSD11B1EPHX2HSD11B2
SCHEMBL14697322 0.73 HSD11B1 (0.54) HSD11B1EPHX2HSD11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103242192-B The inhibitor of 11-beta-hydroxysteroid dehydrogenase 1 type enzyme ABBVIE INC. (US) 2016-05-04 CN disclosed