SCHEMBL8968038

SCHEMBL8968038

Cl[Si](Cl)(Cl)CCCOCCOc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.52
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
TAAR1 Q96RJ0 1/20 0.42
ALDH1A1 P00352 1/20 0.42
RECQL P46063 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL524338 0.91 KCNA3 (0.62) KCNA3HDAC3HDAC4HDAC1HDAC7
SCHEMBL8970420 0.86 KCNA3 (0.48) KCNA3HDAC3HDAC4HDAC1HDAC7
SCHEMBL8967754 0.86 KCNA3 (0.48) KCNA3HDAC3HDAC4HDAC1HDAC7
SCHEMBL2685625 0.83 KCNA3 (0.64) KCNA3HDAC3HDAC4HDAC1HDAC7
SCHEMBL17476338 0.83 KCNA3 (0.64) KCNA3HDAC3HDAC4HDAC1HDAC7
SCHEMBL17476375 0.83 KCNA3 (0.64) KCNA3HDAC3HDAC4HDAC1HDAC7
SCHEMBL17476377 0.83 KCNA3 (0.64) KCNA3HDAC3HDAC4HDAC1HDAC7
SCHEMBL1497968 0.83 KCNA3 (0.64) KCNA3HDAC3HDAC4HDAC1HDAC7
SCHEMBL17476329 0.83 KCNA3 (0.64) KCNA3HDAC3HDAC4HDAC1HDAC7
SCHEMBL17476367 0.83 KCNA3 (0.64) KCNA3HDAC3HDAC4HDAC1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618919-B1 IODINIUM SALTS AND METHOD OF PREPARING THEM WACKER CHEMIE GMBH (DE) 1996-02-28 EP disclosed
US-5468890-A Iodonium salts and process for the preparation thereof WACKER-CHEMIE GMBH (DE) 1995-11-21 US disclosed
EP-0618919-A1 IODINIUM SALTS AND METHOD OF PREPARING THEM. WACKER CHEMIE GMBH (DE) 1994-10-12 EP disclosed
WO-1993013110-A1 IODINIUM SALTS AND METHOD OF PREPARING THEM WACKER-CHEMIE GMBH (DE) 1993-07-08 WO disclosed