SCHEMBL5517754

SCHEMBL5517754

CCOC(=O)Cc1[nH]c2ccc(Oc3ccc(C(C)(C)C)cc3)c(-c3ccc(OC(C)C)cc3)c2c1C(=O)OCC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 8/20 0.35
NR1H4 Q96RI1 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
TDP1 Q9NUW8 2/20 0.35
GABRA1 P14867 2/20 0.35
GABRG2 P18507 2/20 0.35
GABRB3 P28472 2/20 0.35
GABRA5 P31644 2/20 0.35
GABRA3 P34903 2/20 0.35
GABRA2 P47869 2/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRB2 P47870 1/20 0.35
GABRA4 P48169 1/20 0.35
GABRE P78334 1/20 0.35
GABRA6 Q16445 1/20 0.35

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
SCHEMBL5270824 0.92 PTPN1 (0.37) POLBL3MBTL1MAPTMEN1KMT2A
SCHEMBL5516043 0.91 POLB (0.43) POLBL3MBTL1MAPTMEN1KMT2A
SCHEMBL5267628 0.86 PPARD (0.39) POLBMAPTMEN1KMT2ATDP1
SCHEMBL5515208 0.85 MAPT (0.38) POLBL3MBTL1MAPTMEN1KMT2A
SCHEMBL5506461 0.84 ALOX5 (0.40) POLBL3MBTL1MAPTMEN1KMT2A
SCHEMBL5503574 0.84 MEN1 (0.39) POLBMAPTMEN1KMT2ATDP1
SCHEMBL5266671 0.83 POLB (0.41) POLBL3MBTL1MAPTMEN1KMT2A
SCHEMBL5510893 0.83 PPARD (0.39) POLBMAPTMEN1KMT2AALDH1A1
SCHEMBL5506207 0.82 TP53 (0.41) POLBMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL5508283 0.82 TP53 (0.42) POLBMAPTMEN1KMT2ATDP1

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-1841735-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-10-10 EP disclosed
WO-2006077366-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2006-07-27 WO disclosed