SCHEMBL722645

SCHEMBL722645

CC(C)CCCc1ccc(C(=O)O)c(C(=O)O)c1CCC(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.40
GRIN2A Q12879 1/20 0.40
GRIN2B Q13224 1/20 0.40
GRIN2C Q14957 1/20 0.40
HDAC3 O15379 4/20 0.37
HDAC4 P56524 4/20 0.37
HDAC1 Q13547 4/20 0.37
HDAC7 Q8WUI4 4/20 0.37
HDAC2 Q92769 4/20 0.37
HDAC10 Q969S8 4/20 0.37
HDAC11 Q96DB2 4/20 0.37
HDAC8 Q9BY41 4/20 0.37
HDAC6 Q9UBN7 4/20 0.37
HDAC9 Q9UKV0 4/20 0.37
HDAC5 Q9UQL6 4/20 0.37
RARB P10826 1/20 0.34
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34
BID P55957 3/20 0.33
MCL1 Q07820 3/20 0.33

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
SCHEMBL634123 0.95 GRIN2D (0.40) GRIN2DGRIN2AGRIN2BGRIN2CHDAC3
SCHEMBL722646 0.94 GRIN2D (0.40) GRIN2DGRIN2AGRIN2BGRIN2CHDAC3
SCHEMBL541844 0.92 HDAC3 (0.36) GRIN2DGRIN2AGRIN2BGRIN2CHDAC3
SCHEMBL541811 0.91 RARB (0.37) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL721324 0.90 METAP2 (0.40) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL16295022 0.90 PPARA (0.45) RARBBIDMCL1BCL2L1BAK1
SCHEMBL721325 0.90 METAP2 (0.40) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL721825 0.90 BID (0.38) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL10818422 0.90 BID (0.38) GRIN2DGRIN2AGRIN2BGRIN2CRARB
SCHEMBL23670 0.90 BID (0.38) GRIN2DGRIN2AGRIN2BGRIN2CRARB

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
US-8648001-B2 Aminosilane compounds, catalyst components and catalysts for olefin polymerization, and process for production of olefin polymers with the same TOHO TITANIUM CO., LTD. (JP) 2014-02-11 US disclosed
US-20120053310-A1 Aminosilane Compounds, Catalyst Components and Catalysts for Olefin Polymerization, and Process for Production of Olefin Polymers with the Same TOHO TITANIUM CO., LTD. (JP) 2012-03-01 US disclosed