SCHEMBL8662489

SCHEMBL8662489

CCCCCCCCCCCCCCCC(=O)N1CC(O)CC1COC(c1ccccc1)(c1ccccc1)c1cccc(OC)c1OC

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 2/20 0.41
BCHE P06276 4/20 0.33
ACHE P22303 4/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PPARA Q07869 1/20 0.33

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
SCHEMBL8662486 0.92 MTNR1B (0.40) MTNR1BBCHEACHEMAPTMEN1
SCHEMBL6858153 0.86 ITGA4 (0.38) MEN1KMT2A
SCHEMBL26302681 0.85 SLC6A11 (0.42) MTNR1BMAPTMEN1KMT2A
SCHEMBL14978147 0.85 SLC6A11 (0.42) MTNR1BMAPTMEN1KMT2A
SCHEMBL26302685 0.85 SLC6A11 (0.42) MTNR1BMAPTMEN1KMT2A
SCHEMBL9908638 0.85 SLC6A11 (0.42) MTNR1BMAPTMEN1KMT2A
SCHEMBL26302691 0.85 SLC6A11 (0.42) MTNR1BMAPTMEN1KMT2A
SCHEMBL8660379 0.85 SLC6A1 (0.34) MTNR1BMEN1KMT2A
SCHEMBL8661457 0.84 HPGD (0.35)
SCHEMBL9908645 0.84 SLC6A11 (0.42) MTNR1BMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5714606-A OLIGONUCLEOTIDE HAVING RECEPTOR BINDING SITES; ENZYME INHIBITORS, ANTIINFLAMMATORY AGENTS, MEDICAL DIAGNOSIS ISIS PHARMACEUTICALS, INC. (US) 1998-02-03 US disclosed
EP-0739335-A4 PYRROLIDINE-CONTAINING MONOMERS AND OLIGOMERS ISIS PHARMACEUTICALS INC (US) 1997-04-02 EP disclosed
EP-0739335-A1 PYRROLIDINE-CONTAINING MONOMERS AND OLIGOMERS ISIS PHARMACEUTICALS, INC. (US) 1996-10-30 EP disclosed
US-5510476-A SOLID PHASE SYNTHESIS USING AN ACIDIC SOLUTION OF THE SCAVENGER TO DEPROTECT THE 5'-HYDROXY AND NEUTRALIZE THE CARBO ANION RELEASED; HIGH YIELDS ISIS PHARMACEUTICALS, INC. (US) 1996-04-23 US disclosed
WO-1995018792-A1 PYRROLIDINE-CONTAINING MONOMERS AND OLIGOMERS ISIS PHARMACEUTICALS, INC. (US) 1995-07-13 WO disclosed