SCHEMBL1662792

SCHEMBL1662792

CN(C)c1ccc(-c2nc3ccc(C4(c5ccccc5)C=C4)nc3s2)cc1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
APP P05067 11/20 0.50
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
MAOB P27338 3/20 0.43
S1PR1 P21453 5/20 0.42
MAPT P10636 1/20 0.37

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
SCHEMBL1664584 0.85 S1PR1 (0.61) APPS1PR1
SCHEMBL1661564 0.84 S1PR1 (0.50) APPMAOBS1PR1
SCHEMBL1661678 0.84 S1PR1 (0.44) APPMAOBS1PR1
SCHEMBL1662093 0.82 S1PR1 (0.43) MAOBS1PR1
SCHEMBL1660276 0.82 ADORA3 (0.44) MAOBS1PR1
SCHEMBL1664202 0.81 S1PR1 (0.42) APPMAOBS1PR1
SCHEMBL1661765 0.78 S1PR1 (0.41) MAOBS1PR1
SCHEMBL1661196 0.77 S1PR1 (0.39) GLAGAAMAOBS1PR1MAPT
SCHEMBL1662682 0.76 S1PR1 (0.38) MAOBS1PR1
SCHEMBL1661460 0.76 S1PR1 (0.38) MAOBS1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2306994-A1 S1P1 RECEPTOR AGONISTS AND USE THEREOF Amgen, Inc (US) 2011-04-13 EP disclosed
WO-2009154775-A1 S1P1 RECEPTOR AGONISTS AND USE THEREOF AMGEN INC. (US) 2009-12-23 WO disclosed