SCHEMBL4200784

SCHEMBL4200784

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

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 2/20 0.49
POLB P06746 3/20 0.46
LMNA P02545 1/20 0.40
APEX1 P27695 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP3A4 P08684 1/20 0.33
PKM P14618 1/20 0.32
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL4200789 1.00 SMN1; SMN2 (0.49) SMN1; SMN2ALDH1A1POLBLMNAAPEX1
SCHEMBL4200786 0.94 TSHR (0.42) SMN1; SMN2ALDH1A1POLBLMNATSHR
SCHEMBL4200780 0.94 TSHR (0.42) SMN1; SMN2ALDH1A1POLBLMNATSHR
SCHEMBL990584 0.88 ALDH1A1 (0.63) SMN1; SMN2ALDH1A1POLBLMNAAPEX1
SCHEMBL14493389 0.80 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1POLBLMNATSHR
SCHEMBL7755420 0.80 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1POLBLMNATSHR
SCHEMBL4030346 0.77 POLB (0.50) SMN1; SMN2ALDH1A1POLBLMNAAPEX1
SCHEMBL5909556 0.76 POLB (0.64) SMN1; SMN2ALDH1A1POLBAPEX1TDP1
SCHEMBL5909553 0.76 POLB (0.64) SMN1; SMN2ALDH1A1POLBAPEX1TDP1
SCHEMBL7174184 0.74 POLB (0.54) SMN1; SMN2ALDH1A1POLBTDP1TSHR

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 6 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
US-6252028-B1 PLATINUM CATALYST WACKER-CHEMIE GMBH (DE) 2001-06-26 US disclosed