SCHEMBL1648154

SCHEMBL1648154

COc1cc(O)ccc1C=CC(=O)CC(=O)C=Cc1ccc(N(C)C)cc1Cl

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 16/20 0.72
APP P05067 3/20 0.70
MAPT P10636 2/20 0.58
CTSL P07711 1/20 0.51
CTSB P07858 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
MMP9 P14780 1/20 0.51

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
SCHEMBL1648152 1.00 BACE1 (0.72) BACE1APPMAPTCTSLCTSB
SCHEMBL1646604 0.89 APP (0.84) BACE1APPMAPTCTSLCTSB
SCHEMBL1646600 0.89 APP (0.84) BACE1APPMAPTCTSLCTSB
SCHEMBL3212560 0.85 BACE1 (0.81) BACE1APPMAPTMMP9
SCHEMBL3212534 0.85 BACE1 (0.81) BACE1APPMAPTMMP9
SCHEMBL1647252 0.85 BACE1 (0.80) BACE1MAPT
SCHEMBL1647249 0.85 BACE1 (0.80) BACE1MAPT
SCHEMBL9234919 0.84 APP (1.00) BACE1APPMAPTCTSLCTSB
SCHEMBL9234911 0.84 APP (1.00) BACE1APPMAPTCTSLCTSB
SCHEMBL3207902 0.84 BACE1 (1.00) BACE1APPMAPTMMP9

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
US-8552220-B2 Therapeutic agent for Alzheimer's disease TOKYO INSTITUTE OF TECHNOLOGY (JP) 2013-10-08 US disclosed
EP-2305629-A1 THERAPEUTIC AGENT FOR ALZHEIMER'S DISEASE Tokyo Institute of Technology (JP) 2011-04-06 EP disclosed