SCHEMBL4030346

SCHEMBL4030346

O=C(O)C1C2C=CC(C/C=C\C2)C1C(=O)OC(=O)C1C2C=CC(C/C=C\C2)C1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.50
TDP1 Q9NUW8 4/20 0.50
APEX1 P27695 1/20 0.50
ALDH1A1 P00352 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 2/20 0.38
ABAT P80404 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
EGLN1 Q9GZT9 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL5909556 0.87 POLB (0.64) POLBTDP1APEX1ALDH1A1SMN1; SMN2
SCHEMBL5909553 0.87 POLB (0.64) POLBTDP1APEX1ALDH1A1SMN1; SMN2
SCHEMBL572756 0.83 POLB (0.59) POLBTDP1APEX1ALDH1A1SMN1; SMN2
SCHEMBL3777075 0.83 POLB (0.59) POLBTDP1APEX1ALDH1A1SMN1; SMN2
SCHEMBL3787744 0.83 POLB (0.59) POLBTDP1APEX1ALDH1A1SMN1; SMN2
SCHEMBL4665372 0.83 POLB (0.59) POLBTDP1APEX1ALDH1A1SMN1; SMN2
SCHEMBL721693 0.83 POLB (0.74) POLBTDP1APEX1ALDH1A1SMN1; SMN2
SCHEMBL27495 0.83 POLB (0.59) POLBTDP1APEX1ALDH1A1SMN1; SMN2
SCHEMBL6519223 0.80 POLB (0.61) POLBTDP1APEX1ALDH1A1SMN1; SMN2
SCHEMBL4200789 0.77 SMN1; SMN2 (0.49) POLBTDP1APEX1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7511110-B2 Crosslinkable polyorganosiloxane compositions WACKER CHEMIE AG (DE) 2009-03-31 US disclosed
US-7385000-B2 Silicone rubber composition having improved storage stability WACKER CHEMIE AG (DE) 2008-06-10 US disclosed
US-20060135689-A1 Crosslinkable polyorganosiloxane compositions WACKER CHEMIE GMBH (DE) 2006-06-22 US disclosed
US-20060084745-A1 Silicone rubber composition having improved storage stability WACKER-CHEMIE GMBH (DE) 2006-04-20 US disclosed
US-6359098-B1 SHELF LIFE AS ONE-COMPONENT ADDITION-CURABLE ORGANOPOLYSILOXANES, AND EXTENDED POT LIFE FOR TWO-COMPONENT ADDITION-CURABLE ORGANOPOLYSILOXANES, WITHOUT COMPROMISING CROSSLINKING RATES OR LEVELS WACKER-CHEMIE GMBH (DE) 2002-03-19 US disclosed