SCHEMBL2171124

SCHEMBL2171124

Cc1ccc2c(c1)-c1[nH]nc(CO)c1CO2

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.41
MAPT P10636 8/20 0.39
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
KMT2A Q03164 1/20 0.38
TP53 P04637 8/20 0.37
POLB P06746 1/20 0.36
THRB P10828 2/20 0.35
MMP12 P39900 1/20 0.35
ADRA2A P08913 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL2172075 0.78 KDM4E (0.42) PGRMAPTMEN1CYP1A2CYP2C9
SCHEMBL2171158 0.76 TP53 (0.43) MAPTMEN1CYP1A2CYP2C9KMT2A
SCHEMBL2173102 0.76 KDM4E (0.42) MAPTMEN1KMT2ATP53THRB
SCHEMBL2173944 0.73 TP53 (0.40) MAPTMEN1CYP1A2CYP2C9KMT2A
SCHEMBL3518121 0.65 ALDH1A1 (0.43) PGRMAPTMEN1KMT2ALMNA
SCHEMBL12856859 0.62 MMP12 (0.43) PGRMAPTMEN1CYP1A2CYP2C9
SCHEMBL12311607 0.62 MEN1 (0.46) PGRMAPTMEN1CYP1A2CYP2C9
SCHEMBL95448 0.62 MMP12 (0.51) PGRMAPTMEN1CYP1A2CYP2C9
SCHEMBL5952447 0.61 MAP2K4 (0.60) MAPTLMNAHPGDMAPK1
SCHEMBL21574193 0.61 MAPT (0.44) PGRMAPTMEN1CYP1A2CYP2C9

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