SCHEMBL2173304

SCHEMBL2173304

Cn1nc(C(=O)Nc2ccccc2F)c2c1-c1ccccc1OC2

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.68
TP53 P04637 3/20 0.68
MAPT P10636 4/20 0.67
NR1H4 Q96RI1 5/20 0.49
THRB P10828 2/20 0.44
LMNA P02545 2/20 0.43
RIPK1 Q13546 1/20 0.41
NPC1 O15118 1/20 0.41
PKM P14618 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL2172878 0.87 TP53 (0.68) POLBTP53MAPTNR1H4THRB
SCHEMBL2172257 0.85 TP53 (0.75) POLBTP53MAPTNR1H4THRB
SCHEMBL2547306 0.85 MAPT (0.79) POLBTP53MAPTNR1H4THRB
SCHEMBL2172534 0.82 MAPT (0.68) POLBTP53MAPTNR1H4THRB
SCHEMBL2171479 0.81 POLB (0.63) POLBTP53MAPTNR1H4THRB
SCHEMBL2171108 0.81 MAPT (0.79) POLBTP53MAPTNR1H4THRB
SCHEMBL2546404 0.79 MAPT (0.64) POLBTP53MAPT
SCHEMBL2546880 0.79 POLB (0.64) POLBTP53MAPTNR1H4LMNA
SCHEMBL2174453 0.79 MAPT (0.64) POLBTP53MAPTNR1H4
SCHEMBL2549009 0.79 POLB (0.68) POLBTP53MAPTNR1H4THRB

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