SCHEMBL2171936

SCHEMBL2171936

CCN1CCN(Cc2ccc(NC(=O)c3nn(C)c4c3COc3ccccc3-4)cc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.68
MAPT P10636 2/20 0.68
TP53 P04637 7/20 0.67
NR1H4 Q96RI1 3/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.45
USP2 O75604 1/20 0.45
LMNA P02545 1/20 0.44
HRH3 Q9Y5N1 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.42

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
SCHEMBL2547306 0.82 MAPT (0.79) POLBMAPTTP53NR1H4LMNA
SCHEMBL2186610 0.78 MAPT (0.72) POLBMAPTTP53NPC1RAB9A
SCHEMBL2547296 0.78 MAPT (0.69) POLBMAPTTP53NR1H4LMNA
SCHEMBL2172878 0.76 TP53 (0.68) POLBMAPTTP53NR1H4LMNA
SCHEMBL2171100 0.76 MAPT (0.69) POLBMAPTTP53NPC1RAB9A
SCHEMBL2542966 0.74 MAPT (0.70) POLBMAPTTP53NPC1RAB9A
SCHEMBL2542223 0.73 MAPT (0.66) POLBMAPTTP53TSHR
SCHEMBL2174259 0.73 MAPT (0.62) POLBMAPTTP53NR1H4NPC1
SCHEMBL2546880 0.72 POLB (0.64) POLBMAPTTP53NR1H4NPC1
SCHEMBL2174453 0.72 MAPT (0.64) POLBMAPTTP53NR1H4

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-2346832-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS Glaxo Group Limited (GB) 2011-07-27 EP disclosed
WO-2010049366-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2010-05-06 WO disclosed