SCHEMBL9037360

SCHEMBL9037360

COc1ccc(C(=O)c2cn(CCN3CCOCC3)c3c(OCc4ccccc4)cccc23)cc1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.61
CNR1 P21554 8/20 0.58
EGFR P00533 1/20 0.49

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
SCHEMBL9037258 0.84 CNR2 (0.72) CNR2CNR1
SCHEMBL15112248 0.76 CNR2 (0.70) CNR2CNR1
Water SCHEMBL9037716 0.76 CNR2 (0.69) CNR2CNR1
SCHEMBL3820957 0.74 CNR2 (0.66) CNR2CNR1
SCHEMBL9641383 0.72 CNR2 (0.63) CNR2CNR1
SCHEMBL9691579 0.72 CNR1 (0.73) CNR2CNR1
SCHEMBL7217660 0.72 CNR2 (0.81) CNR2CNR1
SCHEMBL12782517 0.72 CNR2 (0.71) CNR2CNR1
SCHEMBL5463245 0.71 CNR2 (0.52) CNR2CNR1
SCHEMBL9036015 0.71 CNR1 (0.74) CNR2CNR1

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-0445781-B1 3-Arylcarbonyl-1-aminoalkyl-1H-indole containing antiglaucoma compositions STERLING WINTHROP INC (US) 1996-01-31 EP disclosed
EP-0445781-A1 3-Arylcarbonyl-1-aminoalkyl-1H-indole containing antiglaucoma compositions STERLING WINTHROP INC. (US) 1991-09-11 EP disclosed
US-5013837-A Treatment of glaucoma STERLING DRUG INC. (US) 1991-05-07 US disclosed
US-4973587-A 3-arylcarbonyl-1-aminoalkyl-1H-indole-containing antiglaucoma method STERLING DRUG INC. (US) 1990-11-27 US disclosed