SCHEMBL5439348

SCHEMBL5439348

O=S(=O)(c1ccccc1Cl)N1CCCN(c2ncccc2C(F)(F)F)CC1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 20/20 0.72

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
SCHEMBL3213850 0.96 HSD11B1 (0.78) HSD11B1
SCHEMBL5327380 0.88 HSD11B1 (0.70) HSD11B1
SCHEMBL5360560 0.85 HSD11B1 (0.62) HSD11B1
SCHEMBL3218052 0.82 HSD11B1 (0.66) HSD11B1
SCHEMBL3608843 0.81 HSD11B1 (1.00) HSD11B1
SCHEMBL3210183 0.80 HSD11B1 (1.00) HSD11B1
SCHEMBL3212651 0.80 HSD11B1 (0.67) HSD11B1
SCHEMBL3222429 0.79 HSD11B1 (0.56) HSD11B1
SCHEMBL3215217 0.79 HSD11B1 (0.72) HSD11B1
SCHEMBL3224595 0.79 HSD11B1 (0.66) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007122411-A1 DIAZEPAN-1-YL-SULFONYL DERIVATIVES FOR THE TREATMENT OF METABOLIC SYNDROME ASTRAZENECA AB (SE) 2007-11-01 WO disclosed