SCHEMBL7945284

SCHEMBL7945284

CNCC12CCC(c3nnc(-c4ccccc4C(F)(F)F)n3C)(CC1)CC2

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 18/20 0.76
HSD11B2 P80365 7/20 0.70

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
SCHEMBL3235667 0.86 HSD11B1 (0.73) HSD11B1HSD11B2
SCHEMBL3231832 0.86 HSD11B1 (0.73) HSD11B1HSD11B2
SCHEMBL3237810 0.85 HSD11B1 (0.68) HSD11B1HSD11B2
SCHEMBL3230804 0.84 HSD11B1 (0.71) HSD11B1HSD11B2
SCHEMBL3232277 0.84 HSD11B1 (0.69) HSD11B1HSD11B2
SCHEMBL7943138 0.84 HSD11B1 (0.69) HSD11B1HSD11B2
SCHEMBL7950776 0.84 HSD11B1 (0.69) HSD11B1HSD11B2
SCHEMBL3232716 0.83 HSD11B1 (0.69) HSD11B1HSD11B2
SCHEMBL3232705 0.83 HSD11B1 (0.69) HSD11B1HSD11B2
SCHEMBL3226092 0.83 HSD11B1 (0.68) HSD11B1HSD11B2

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
WO-2010011917-A1 SEH AND 11β-HSD1 DUAL INHIBITORS GLAXOSMITHKLINE LLC (US) 2010-01-28 WO disclosed