SCHEMBL10385296

SCHEMBL10385296

CCC(CC)(C(=O)[O-])C(=O)[O-].CCCC[Sn+2]CCCC

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.37
CES1 P23141 6/20 0.36
CES2 O00748 5/20 0.36
CA2 P00918 2/20 0.31
FFAR3 O14843 2/20 0.31
HDAC3 O15379 2/20 0.31
HDAC1 Q13547 2/20 0.31
HDAC2 Q92769 2/20 0.31
HDAC8 Q9BY41 2/20 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
SCHEMBL10385291 0.92 CES2 (0.40) CA1CES1CES2CA2
SCHEMBL2145650 0.90 CES1 (0.33) CA1CES1CES2
Pivalate SCHEMBL6561622 0.83 CA1 (0.39) CA1CES1CES2CA2FFAR3
Bicarbonate SCHEMBL27704869 0.82 CA1 (0.46) CA1CES1CES2CA2FFAR3
Trifluoroacetic Acid SCHEMBL8973999 0.81 FAAH (0.43) CA1CES1CES2
Oxalic Acid SCHEMBL4020981 0.80 CA1 (0.44) CA1CES1CES2CA2FFAR3
Acetic Acid SCHEMBL37323 0.80 CES1 (0.44) CA1CES1CES2CA2FFAR3
SCHEMBL11857441 0.79 CA1 (0.37) CA1CES1CES2CA2FFAR3
SCHEMBL7053452 0.79 CA1 (0.37) CA1CES1CES2CA2FFAR3
SCHEMBL392651 0.79 CA1 (0.33) CA1CES1CES2

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
WO-1987005037-A1 ROOM TEMPERATURE VULCANIZABLE ORGANOPOLYSILOXANE COMPOSITIONS AND METHOD FOR MAKING GENERAL ELECTRIC COMPANY (US) 1987-08-27 WO claimed
US-4554310-A Room temperature vulcanizable organopolysiloxane compositions and method for making GENERAL ELECTRIC COMPANY (US) 1985-11-19 US claimed
US-4891402-A Organic silicon-nitrogen compositions and their use as adhesion promoters in room temperature vulcanizable polydiorganosiloxane compositions GENERAL ELECTRIC COMPANY (US) 1990-01-02 US disclosed
WO-1987005037-A1 ROOM TEMPERATURE VULCANIZABLE ORGANOPOLYSILOXANE COMPOSITIONS AND METHOD FOR MAKING GENERAL ELECTRIC COMPANY (US) 1987-08-27 WO disclosed
US-4554310-A Room temperature vulcanizable organopolysiloxane compositions and method for making GENERAL ELECTRIC COMPANY (US) 1985-11-19 US disclosed
US-4554338-A Room temperature vulcanizable organopolysiloxane compositions and method for making GENERAL ELECTRIC COMPANY (US) 1985-11-19 US disclosed