SCHEMBL7818093

SCHEMBL7818093

CCOC(=O)CN1CCOC(CN2c3ccccc3CCc3ccccc32)C1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.44
NR1I3 Q14994 1/20 0.42
KDM4E B2RXH2 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL7608772 0.85 ALDH1A1 (0.41)
SCHEMBL11678711 0.84 KMT2A (0.47) NOTUMKDM4EKMT2A
Oxalic Acid SCHEMBL7832615 0.83 ALDH1A1 (0.45) KDM4EKMT2A
SCHEMBL11678636 0.82 HRH3 (0.41)
SCHEMBL7829391 0.80 SLC6A1 (0.46) NOTUMNR1I3KDM4EKMT2A
SCHEMBL11680936 0.78 CHRM2 (0.40)
SCHEMBL11678169 0.77 SLC6A1 (0.42)
SCHEMBL11679331 0.77 SLC22A1 (0.41)
SCHEMBL11680271 0.77 NOTUM (0.43) NOTUMKMT2A
SCHEMBL11677581 0.76 SIGMAR1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6214816-B1 ANTIDIABETIC AGENTS, ANALGESICS AND ANTIINFLAMMATORY AGENTS NOVO NORDISK A/S (DK) 2001-04-10 US disclosed
EP-1071679-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 2001-01-31 EP disclosed
WO-1999047517-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1999-09-23 WO disclosed