SCHEMBL7562791

SCHEMBL7562791

CCC/C(C#C[Si](C)(C)C)=C\C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
CES2 O00748 1/20 0.30
CES1 P23141 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
SCHEMBL7562797 1.00 FFAR3 (0.33) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL6479878 0.80 NPSR1 (0.41)
SCHEMBL6479882 0.80 NPSR1 (0.41)
SCHEMBL6473239 0.72 HDAC3 (0.39) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL6473242 0.72 HDAC3 (0.39) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL7559526 0.70 KMT2A (0.33)
SCHEMBL7559530 0.70 KMT2A (0.33)
SCHEMBL11347415 0.64 CES1 (0.42) CES2CES1
SCHEMBL3939667 0.64
SCHEMBL3939673 0.64

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-0986537-B1 NOVEL HETEROETHYNYLENE COMPOUNDS AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME GALDERMA RES & DEV (FR) 2002-08-07 EP disclosed
EP-0986537-A2 NOVEL HETEROETHYNYLENE COMPOUNDS AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME Galderma Research & Development, S.N.C. (FR) 2000-03-22 EP disclosed
WO-1999050239-A2 NOVEL HETEROETHYNYLENE COMPOUNDS AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 1999-10-07 WO disclosed