SCHEMBL3625904

SCHEMBL3625904

C[C@@H]1CN(c2ccc(F)cc2C(F)(F)F)CCN1S(=O)(=O)c1cccc([C@](O)(C(N)=O)C(F)(F)F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 1.00

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
SCHEMBL3628900 1.00 HSD11B1 (1.00) HSD11B1
SCHEMBL3629343 1.00 HSD11B1 (1.00) HSD11B1
SCHEMBL3627227 0.91 HSD11B1 (1.00) HSD11B1
SCHEMBL3628438 0.91 HSD11B1 (1.00) HSD11B1
SCHEMBL3627956 0.91 HSD11B1 (1.00) HSD11B1
SCHEMBL3210316 0.90 HSD11B1 (0.81) HSD11B1
Hsd-016 SCHEMBL3219515 0.88 HSD11B1 (1.00) HSD11B1
Hsd-016 SCHEMBL29358944 0.88 HSD11B1 (1.00) HSD11B1
Hsd-016 SCHEMBL3213640 0.88 HSD11B1 (1.00) HSD11B1
Hsd-016 SCHEMBL3212579 0.88 HSD11B1 (1.00) 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
WO-2010141550-A2 11-BETA HSD1 INHIBITORS WYETH LLC (US) 2010-12-09 WO claimed
WO-2010141550-A2 11-BETA HSD1 INHIBITORS WYETH LLC (US) 2010-12-09 WO disclosed