SCHEMBL4845571

SCHEMBL4845571

O=C1NC(=O)C(Cc2ccc3[nH]c4ccc(C(c5ccccc5)(c5ccccc5)c5ccccc5)cc4c3c2)S1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.49
ALDH1A1 P00352 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MAPT P10636 1/20 0.45
PTPN1 P18031 2/20 0.44
FFAR1 O14842 6/20 0.43
AKT1 P31749 1/20 0.43
PIK3CA P42336 1/20 0.43
MAOA P21397 2/20 0.42
CISD1 Q9NZ45 2/20 0.42
MAOB P27338 2/20 0.41
PPARA Q07869 1/20 0.40
CA2 P00918 1/20 0.40

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
SCHEMBL4773524 0.85 PPARG (0.53) PPARGALDH1A1NPSR1MAPTPTPN1
SCHEMBL4780386 0.79 KIF11 (0.34) PPARGALDH1A1MAPTMAOB
SCHEMBL4778011 0.73 CA2 (0.60) PPARGALDH1A1NPSR1MAPTPTPN1
SCHEMBL166570 0.72 PPARG (0.74) PPARGALDH1A1NPSR1MAPTFFAR1
SCHEMBL13846702 0.70 PPARG (0.59) PPARGALDH1A1NPSR1MAPTPTPN1
SCHEMBL9570559 0.70 MAPT (0.83) PPARGALDH1A1NPSR1MAPTPTPN1
SCHEMBL6866703 0.70 PPARG (0.71) PPARGALDH1A1NPSR1MAPTFFAR1
SCHEMBL6202350 0.69 FFAR1 (0.73) PPARGALDH1A1NPSR1MAPTPTPN1
SCHEMBL8932655 0.69 ALDH1A1 (0.43) PPARGALDH1A1NPSR1MAPTPTPN1
SCHEMBL24398177 0.69 KIF11 (0.71) ALDH1A1MAPT

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
WO-2007119600-A9 CARBAZOLE COMPOUND OTSUKA PHARMA CO LTD (JP) 2008-05-02 WO disclosed
WO-2007119600-A1 CARBAZOLE COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-10-25 WO disclosed