SCHEMBL6012048

SCHEMBL6012048

Cc1cccc(C)c1-c1cccn2c(CC(=O)c3cn(C)cn3)cnc12

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.33
HDAC8 Q9BY41 1/20 0.32
TP53 P04637 2/20 0.31
MAPT P10636 1/20 0.31
LMNA P02545 1/20 0.31
SLC6A9 P48067 1/20 0.30
KCNH2 Q12809 1/20 0.30
SLC6A5 Q9Y345 1/20 0.30
IDO1 P14902 1/20 0.30

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
SCHEMBL6011919 0.81 MYC (0.42) MYCHDAC8TP53MAPTLMNA
SCHEMBL6011820 0.81 MYC (0.33) MYCHDAC8TP53MAPTLMNA
SCHEMBL4591126 0.81 MYC (0.42) MYCHDAC8TP53MAPTLMNA
SCHEMBL5409716 0.74 KDM4E (0.37) MYCHDAC8MAPTIDO1
SCHEMBL6012068 0.73 PDE4D (0.43) MAPT
SCHEMBL6012030 0.73 MYC (0.34) MYCHDAC8TP53MAPTLMNA
SCHEMBL6011791 0.71 TAS2R8 (0.35) MAPT
SCHEMBL23030047 0.67 HDAC8 (0.47) HDAC8TP53MAPTLMNA
Hydrochloric Acid SCHEMBL17371704 0.67 HDAC8 (0.49) HDAC8TP53MAPTLMNA
SCHEMBL1516345 0.65 LMNA (0.47) HDAC8MAPTLMNASLC6A9KCNH2

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-1682549-A2 IMIDAZO[1,2-A]PYRIDINE ANXIOLYTICS Sepracor Inc. (US) 2006-07-26 EP disclosed
WO-2005044818-A2 IMIDAZO[1,2-A]PYRIDINE ANXIOLYTICS SEPRACOR, INC. (US) 2005-05-19 WO disclosed