SCHEMBL5345272

SCHEMBL5345272

CCOC(=O)c1[nH]c2ccc(OCc3ccccc3)c(-c3ccc(OC(C)C)cc3)c2c1N(C)C(=O)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
GABRA1 P14867 6/20 0.40
GABRG2 P18507 6/20 0.40
GABRB3 P28472 6/20 0.40
GABRA5 P31644 6/20 0.40
GABRA3 P34903 6/20 0.40
GABRA2 P47869 6/20 0.40
GABRP O00591 4/20 0.40
GABRD O14764 4/20 0.40
GABRB1 P18505 4/20 0.40
GABRB2 P47870 4/20 0.40
GABRA4 P48169 4/20 0.40
GABRE P78334 4/20 0.40
GABRA6 Q16445 4/20 0.40
GABRG1 Q8N1C3 4/20 0.40
GABRG3 Q99928 4/20 0.40
GABRQ Q9UN88 4/20 0.40
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 3/20 0.39

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
SCHEMBL5268051 0.85 MAPT (0.42) MAPTGABRA1GABRG2GABRB3GABRA5
SCHEMBL5276098 0.84 MAPT (0.44) MAPTGABRA1GABRG2GABRB3GABRA5
SCHEMBL5274888 0.84 KDM4E (0.49) MAPTGABRA1GABRG2GABRB3GABRA5
SCHEMBL5271822 0.82 MAPT (0.49) MAPTGABRA1GABRG2GABRB3GABRA5
SCHEMBL5269996 0.81 MAPT (0.40) MAPTGABRA1GABRG2GABRB3GABRA5
SCHEMBL5340346 0.76 MAPT (0.43) MAPTGABRA1GABRG2GABRB3GABRA5
SCHEMBL5264728 0.76 ALDH1A1 (0.57) MAPTGABRA1GABRG2GABRB3GABRA5
SCHEMBL5273322 0.74 GABRA1 (0.49) MAPTGABRA1GABRG2GABRB3GABRA5
SCHEMBL5336428 0.70 MAPT (0.39) MAPTGABRA1GABRG2GABRB3GABRA5
SCHEMBL5512949 0.69 MAPT (0.46) MAPTGABRA1GABRG2GABRB3GABRA5

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-1844013-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-10-17 EP disclosed
WO-2006077364-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2006-07-27 WO disclosed