SCHEMBL6012067

SCHEMBL6012067

Cc1cccc(-c2ccc3ncc(CC(=O)c4c(C)nn(-c5ccccc5)c4C)n3c2)c1C

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.41
TGFBR1 P36897 6/20 0.39
P2RX7 Q99572 1/20 0.39
RAB9A P51151 5/20 0.39
MAPT P10636 3/20 0.39
NPSR1 Q6W5P4 1/20 0.39
NPC1 O15118 4/20 0.38
WNT3A P56704 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
POLB P06746 2/20 0.36

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
SCHEMBL6012059 0.80 TGFBR1 (0.47) TGFBR1
SCHEMBL6012097 0.78 TGFBR1 (0.40) TGFBR1
SCHEMBL6012068 0.77 PDE4D (0.43) PDE4DP2RX7RAB9AMAPTNPSR1
SCHEMBL6012047 0.76 TGFBR1 (0.41) TGFBR1
SCHEMBL6011819 0.75 TGFBR1 (0.40) TGFBR1
SCHEMBL6012051 0.74 TGFBR1 (0.43) TGFBR1
SCHEMBL5409710 0.72 TGFBR1 (0.41) TGFBR1MAPTNPSR1TSHR
SCHEMBL6012071 0.70 NR1H4 (0.45) PDE4DP2RX7RAB9AMAPTNPSR1
SCHEMBL6011787 0.70 TGFBR1 (0.38) TGFBR1
SCHEMBL2938107 0.67 GABRB2 (0.55) PDE4DRAB9AMAPTNPC1

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