SCHEMBL6894816

SCHEMBL6894816

NC(Cc1ccccc1)C(O)CNCc1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.53
GAA P10253 1/20 0.49
DNM1 Q05193 3/20 0.47
OPRD1 P41143 1/20 0.46
OPRK1 P41145 1/20 0.46
SLC6A4 P31645 1/20 0.46
ANPEP P15144 1/20 0.46
BACE1 P56817 2/20 0.45
SLC6A11 P48066 1/20 0.45
LMNA P02545 1/20 0.44

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
SCHEMBL3351836 1.00 BCHE (0.53) BCHEGAADNM1OPRD1OPRK1
SCHEMBL3353939 0.91 BCHE (0.61) BCHEDNM1OPRD1OPRK1ANPEP
SCHEMBL496172 0.91 BCHE (0.61) BCHEDNM1OPRD1OPRK1ANPEP
SCHEMBL7951036 0.91 BCHE (0.61) BCHEDNM1OPRD1OPRK1ANPEP
SCHEMBL2605624 0.91 BCHE (0.61) BCHEDNM1OPRD1OPRK1ANPEP
Hydrochloric Acid SCHEMBL497150 0.90 BCHE (0.60) BCHEDNM1OPRD1OPRK1ANPEP
Hydrochloric Acid SCHEMBL5225060 0.90 BCHE (0.60) BCHEDNM1OPRD1OPRK1ANPEP
SCHEMBL3349419 0.87 BCHE (0.49) BCHEDNM1OPRD1OPRK1ANPEP
SCHEMBL3348102 0.86 ANPEP (0.48) BCHESLC6A4ANPEPLMNA
SCHEMBL6890169 0.86 ANPEP (0.48) BCHESLC6A4ANPEPLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2004502669-A 2004-01-29 JP claimed
EP-1353898-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2003-10-22 EP claimed
WO-2002002512-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-01-10 WO claimed