SCHEMBL7471263

SCHEMBL7471263

CCOC(=O)c1[nH]c2ccc(OCc3ccccc3)cc2c1Cc1cc2c(cc1Cl)OCO2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.51
GABRG2 P18507 4/20 0.51
GABRB3 P28472 4/20 0.51
GABRA5 P31644 4/20 0.51
GABRA3 P34903 4/20 0.51
GABRA2 P47869 4/20 0.51
MAPT P10636 5/20 0.49
HPGD P15428 5/20 0.49
KDM4E B2RXH2 3/20 0.49
HSD17B10 Q99714 2/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
ALDH1A1 P00352 6/20 0.48
GABRP O00591 1/20 0.48
GABRD O14764 1/20 0.48
GABRB1 P18505 1/20 0.48
GABRB2 P47870 1/20 0.48
GABRA4 P48169 1/20 0.48
GABRE P78334 1/20 0.48
GABRA6 Q16445 1/20 0.48

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
SCHEMBL7472621 0.93 MAPT (0.51) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL7458907 0.90 MAPT (0.43) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL7461988 0.90 MAOB (0.43) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL7466748 0.90 KDM4E (0.49) MAPTHPGDKDM4EHSD17B10LMNA
SCHEMBL7462845 0.85 ALOX5 (0.49) MAPTHPGDKDM4EHSD17B10LMNA
SCHEMBL7465568 0.84 EDNRB (0.47) MAPTHPGDKDM4EHSD17B10LMNA
SCHEMBL7465999 0.83 NR4A2 (0.42) MAPTHPGDKDM4EHSD17B10LMNA
SCHEMBL7466286 0.83 MAOA (0.49) MAPTHPGDKDM4EHSD17B10LMNA
SCHEMBL7467140 0.82 MRGPRX4 (0.49) MAOB
SCHEMBL7470931 0.81 MAOA (0.49) MAOB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1021181-A4 CARBOXYLIC ACID INDOLE INHIBITORS OF CHEMOKINES SMITHKLINE BEECHAM CORP (US) 2002-06-26 EP disclosed
EP-1021181-A1 CARBOXYLIC ACID INDOLE INHIBITORS OF CHEMOKINES SMITHKLINE BEECHAM CORPORATION (US) 2000-07-26 EP disclosed
WO-1997035572-A1 CARBOXYLIC ACID INDOLE INHIBITORS OF CHEMOKINES SMITHKLINE BEECHAM CORPORATION (US) 1997-10-02 WO disclosed