SCHEMBL4508231

SCHEMBL4508231

CCCC(c1ccccc1)c1ccccc1OOP(C)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 4/20 0.36
POLB P06746 2/20 0.36
AOC3 Q16853 2/20 0.35
LMNA P02545 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SRC P12931 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
PPARG P37231 1/20 0.32

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
SCHEMBL6330054 0.76 MEN1 (0.51) POLBMEN1KMT2A
SCHEMBL6745681 0.76 MEN1 (0.40) POLBAOC3LMNAMEN1KMT2A
SCHEMBL6745678 0.76 KDM4E (0.41) POLBAOC3MEN1KMT2APPARG
Hydrogen Peroxide SCHEMBL27864054 0.68 HRH1 (0.54) AOC3LMNAMEN1KMT2A
SCHEMBL1837685 0.68 TSHR (0.52) POLBAOC3LMNAMEN1KMT2A
SCHEMBL28491387 0.68 ALDH1A1 (0.39) LMNAMEN1KMT2A
SCHEMBL8488783 0.68 ALDH1A1 (0.54) MEN1KMT2AADRB2PPARG
SCHEMBL16824139 0.67 ALDH1A1 (0.47) POLBAOC3LMNAMEN1KMT2A
SCHEMBL27449474 0.66 L3MBTL1 (0.45) POLBLMNAMEN1KMT2A
SCHEMBL107889 0.66 HRH1 (0.56) AOC3LMNAMEN1KMT2AADRB2

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-1689383-A4 NOVEL PHOSPHORUS-CONTAINING THYROMIMETICS METABASIS THERAPEUTICS INC (US) 2009-02-18 EP disclosed
EP-1689383-A2 NOVEL PHOSPHORUS-CONTAINING THYROMIMETICS Metabasis Therapeutics, Inc. (US) 2006-08-16 EP disclosed
WO-2005051298-A2 NOVEL PHOSPHORUS-CONTAINING THYROMIMETICS METABASIS THERAPEUTICS, INC. (US) 2005-06-09 WO disclosed