SCHEMBL9416638

SCHEMBL9416638

COc1ccc(CC2c3cc(OCc4ccccc4)c(OC)cc3CCN2C(C)=O)cc1OCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 3/20 0.67
HCRTR1 O43613 5/20 0.59
HCRTR2 O43614 5/20 0.59
PDE4D Q08499 3/20 0.58
LMNA P02545 1/20 0.58
MAPT P10636 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58

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
SCHEMBL9637846 0.92 MTNR1B (0.64) MTNR1BHCRTR1HCRTR2PDE4DLMNA
SCHEMBL31538834 0.90 LMNA (0.68) MTNR1BHCRTR1HCRTR2PDE4DLMNA
SCHEMBL13064945 0.90 LMNA (0.68) MTNR1BHCRTR1HCRTR2PDE4DLMNA
SCHEMBL30585089 0.85 LMNA (0.79) LMNA
SCHEMBL9637922 0.85 LMNA (0.61) MTNR1BHCRTR1HCRTR2PDE4DLMNA
SCHEMBL9585990 0.85 LMNA (0.79) LMNA
SCHEMBL5097146 0.85 MTNR1B (0.70) MTNR1BHCRTR1HCRTR2PDE4D
SCHEMBL29059153 0.83 HCRTR1 (0.62) HCRTR1HCRTR2LMNA
SCHEMBL17821870 0.82 MTNR1B (0.60) MTNR1BLMNAMAPT
SCHEMBL3506766 0.82 MTNR1B (0.69) MTNR1BHCRTR1HCRTR2PDE4D

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
EP-0613879-A1 PHELLODENDRINE ANALOGS AND ALLERGY TYPE IV SUPPRESSOR CONTAINING THE SAME AS ACTIVE INGREDIENT TSUMURA & CO. (JP) 1994-09-07 EP disclosed