Sugi Predict

Sugi Predict / Compounds / SCHEMBL6205982

SCHEMBL6205982

SCHEMBL6205982

CCCCC1(CC)C(=O)[SH]c2cc(OCC(=O)N[C@@H](C(=O)NCCN(C(N)=O)c3ccccn3)c3ccccc3)c(SC)cc2N(c2ccccc2)C1=O

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 1/20 0.39
▸ ELANE P08246 1/20 0.30

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
SCHEMBL5709164 0.95 NR1H4 (0.40) NR1H4ELANE
SCHEMBL5711786 0.89 NR1H4 (0.39) NR1H4ELANE
SCHEMBL4783554 0.88 NR1H4 (0.43) NR1H4ELANE
SCHEMBL5691316 0.87 NR1H4 (0.45) NR1H4ELANE
SCHEMBL3853019 0.86 NR1H4 (0.41) NR1H4ELANE
SCHEMBL4741522 0.85 NR1H4 (0.44) NR1H4ELANE
SCHEMBL4662900 0.85 NR1H4 (0.42) NR1H4ELANE
SCHEMBL4782192 0.85 NR1H4 (0.42) NR1H4ELANE
SCHEMBL5707135 0.85 NR1H4 (0.42) NR1H4ELANE
SCHEMBL4729688 0.84 NR1H4 (0.43) NR1H4ELANE

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
EP-1521742-A1 DIPHENYLAZETIDINONE DERIVATIVES FOR TREATING DISORDERS OF THE LIPID METABOLISM AstraZeneca AB (SE) 2005-04-13 — — EP disclosed
WO-2004005247-A1 DIPHENYLAZETIDINONE DERIVATIVES FOR TREATING DISORDERS OF THE LIPID METABOLISM ASTRAZENECA AB (SE) 2004-01-15 — — WO disclosed