SCHEMBL9498549

SCHEMBL9498549

C=CCCCO[SiH](Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KCNA3 P22001 1/20 0.36
ESR1 P03372 1/20 0.33
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
THRB P10828 1/20 0.33
TLR8 Q9NR97 1/20 0.32
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC11 Q96DB2 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 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
SCHEMBL9496214 0.89 ALDH1A1 (0.37) ALDH1A1L3MBTL1KCNA3KDM4EMEN1
SCHEMBL22654269 0.78 CYP3A4 (0.36) ALDH1A1KCNA3KDM4EMEN1KMT2A
SCHEMBL7980722 0.77 ALDH1A1 (0.62) ALDH1A1L3MBTL1KCNA3KDM4EMEN1
SCHEMBL5355452 0.77 LTA4H (0.53) ALDH1A1L3MBTL1KCNA3ESR1SMN1; SMN2
SCHEMBL3358612 0.75 THRB (0.57) ALDH1A1KCNA3KDM4EMEN1KMT2A
SCHEMBL3354969 0.75 HDAC3 (0.58) ALDH1A1KCNA3HDAC3HDAC4HDAC1
SCHEMBL1608984 0.75 LTA4H (0.53) ALDH1A1KCNA3ESR1SMN1; SMN2DRD2
SCHEMBL14957056 0.75 ALDH1A1 (0.44) ALDH1A1L3MBTL1KCNA3ESR1KDM4E
SCHEMBL2168159 0.75 ALDH1A1 (0.40) ALDH1A1L3MBTL1KCNA3ESR1KDM4E
SCHEMBL15302066 0.72 ALDH1A1 (0.41) ALDH1A1L3MBTL1ESR1KDM4ETLR8

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-0267794-B1 PROCESS FOR PREPARING POLYOLEFINS Nippon Petrochemicals Co., Ltd. (JP) 1993-05-05 EP disclosed
EP-0267794-A2 Process for preparing polyolefins Nippon Petrochemicals Co., Ltd. (JP) 1988-05-18 EP disclosed
US-4619981-A PULVERIZING MAGNESIUM HALIDE, SILANOL, AROMATIC ALCOHOL AND ETHER, POLYMERIZATION CATALYSTS NIPPON OIL COMPANY, LIMITED (JP) 1986-10-28 US disclosed
US-4525555-A TITANIUM COMPOUND SUPPORTED ON SOLID REACTION PRODUCT OF MAGNESIUM HALIDE, SILOXANES, ORGANIC COMPOUNDS NIPPON OIL COMPANY, LIMITED (JP) 1985-06-25 US disclosed