SCHEMBL11255778

SCHEMBL11255778

CC(=O)OC(COc1ccccc1)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.50
MTNR1B P49286 4/20 0.50
LMNA P02545 1/20 0.47
PPARG P37231 1/20 0.47
PPARA Q07869 1/20 0.47
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.46
MAOA P21397 1/20 0.44
PTGS1 P23219 1/20 0.44
THRB P10828 1/20 0.43
PARP10 Q53GL7 1/20 0.42
SCN4A P35499 2/20 0.42
ALOX15 P16050 1/20 0.42
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL7242378 0.87 PPARG (0.56) MTNR1AMTNR1BLMNAPPARGPPARA
SCHEMBL11259813 0.84 MTNR1A (0.50) MTNR1AMTNR1BLMNAPPARGPPARA
SCHEMBL11019359 0.81 PPARG (0.62) MTNR1AMTNR1BLMNAPPARGPPARA
SCHEMBL3364884 0.80 POLB (0.60) MTNR1AMTNR1BLMNAMAPTPOLB
SCHEMBL11258444 0.79 MTNR1A (0.56) MTNR1AMTNR1BLMNAPPARGPPARA
SCHEMBL578331 0.78 MTNR1A (0.58) MTNR1AMTNR1BLMNAMAPTPOLB
SCHEMBL11629144 0.77 POLB (0.55) MTNR1AMTNR1BLMNAMAPTPOLB
SCHEMBL29156974 0.77 SRR (0.54) PPARGPPARAPTGS1ALDH1A1
SCHEMBL9130845 0.77 MTNR1A (0.53) MTNR1AMTNR1BLMNAPPARGPPARA
Hydrochloric Acid SCHEMBL11756567 0.76 POLB (0.54) MTNR1AMTNR1BLMNAMAPTPOLB

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
US-4332959-A STARTING WITH PHENOXYACETALDEHYDE AND ALKALI METAL CYANIDE SUCRERIES DU SOISSONNAIS ET COMPAGNIE SUCRIERE (FR) 1982-06-01 US disclosed