SCHEMBL6572638

SCHEMBL6572638

[CH]1CCNC1Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
GBA1 P04062 1/20 0.46
SLC22A1 O15245 1/20 0.42
PRCP P42785 1/20 0.42
HDAC8 Q9BY41 2/20 0.39
ADRB2 P07550 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
SCHEMBL5505488 0.81 POLB (0.43) POLBGBA1SLC22A1PRCPHDAC8
SCHEMBL8209902 0.74 HDAC8 (0.41) POLBGBA1SLC22A1PRCPHDAC8
SCHEMBL4679652 0.71 POLB (0.58) POLBGBA1SLC22A1PRCP
SCHEMBL2001366 0.70 GBA1 (0.52) POLBGBA1SLC22A1PRCPHDAC8
SCHEMBL8125961 0.70 SLC22A1 (0.41) POLBGBA1SLC22A1PRCPADRB2
SCHEMBL15229389 0.69 GBA1 (0.47) POLBGBA1
SCHEMBL17542064 0.68 POLB (0.71) POLBGBA1
Hydrochloric Acid SCHEMBL27721964 0.68 POLB (0.50) POLBGBA1SLC22A1PRCPHDAC8
SCHEMBL17542062 0.68 POLB (0.71) POLBGBA1
SCHEMBL9579800 0.68 POLB (0.42) POLBGBA1SLC22A1PRCPHDAC8

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-1395551-A2 HYDROXY ALKYL AMINE DERIVATIVES AS BETA-SECRETASE INHIBITORS AND THEIR USE FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND SIMILAR DISEASES Elan Pharmaceuticals, Inc. (US) 2004-03-10 EP claimed
WO-2002098849-A2 HYDROXY ALKYL AMINE DERIVATIVES AS BETA-SECRETASE INHIBITORS AND THEIR USE FOR THE TREATMENT OF ALZHEIMER’S DISEASE AND SIMILAR DISEASES ELAN PHARMACEUTICALS, INC. (US) 2002-12-12 WO claimed
EP-1395551-A2 HYDROXY ALKYL AMINE DERIVATIVES AS BETA-SECRETASE INHIBITORS AND THEIR USE FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND SIMILAR DISEASES Elan Pharmaceuticals, Inc. (US) 2004-03-10 EP disclosed
WO-2002098849-A2 HYDROXY ALKYL AMINE DERIVATIVES AS BETA-SECRETASE INHIBITORS AND THEIR USE FOR THE TREATMENT OF ALZHEIMER’S DISEASE AND SIMILAR DISEASES ELAN PHARMACEUTICALS, INC. (US) 2002-12-12 WO disclosed