SCHEMBL7459648

SCHEMBL7459648

Oc1cn[nH]c1.Oc1cnn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.38
AKT1 P31749 1/20 0.34
AKT2 P31751 1/20 0.34
EPHX2 P34913 1/20 0.34

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
SCHEMBL7254281 0.86 GAA (0.48) GAAEPHX2
SCHEMBL7256256 0.74 AKT1 (0.34) AKT1AKT2
SCHEMBL21233040 0.70 KDM4E (0.39) GAA
SCHEMBL277590 0.68
SCHEMBL511015 0.66 ALDH1A1 (0.38)
SCHEMBL70574 0.66 L3MBTL1 (0.44) AKT1AKT2
SCHEMBL8313319 0.66 KCNN4 (0.36)
SCHEMBL27743631 0.66 MAPT (0.37)
SCHEMBL69872 0.66 KCNN4 (0.36)
SCHEMBL18229954 0.66 KCNN4 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1036064-A4 SELECTIVE BETA 3-ADRENERGIC AGONISTS LILLY CO ELI (US) 2002-11-27 EP disclosed
EP-1036064-A1 SELECTIVE BETA 3-ADRENERGIC AGONISTS ELI LILLY AND COMPANY (US) 2000-09-20 EP disclosed
WO-1999029673-A1 SELECTIVE β3 ADRENERGIC AGONISTS ELI LILLY AND COMPANY (US) 1999-06-17 WO disclosed
WO-1999029672-A1 SELECTIVE β3 ADRENERGIC AGONISTS ELI LILLY AND COMPANY (US) 1999-06-17 WO disclosed