SCHEMBL1582989

SCHEMBL1582989

CCC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Zr](C1C(CC)=Cc2c(-c3cccc4ccccc34)cccc21)=[Si](C)C

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 5/20 0.33
SLC6A2 P23975 1/20 0.32
SLC6A3 Q01959 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
HTR7 P34969 1/20 0.31
KDM1A O60341 1/20 0.31
DRD2 P14416 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
Hydrochloric Acid SCHEMBL5604464 0.99 SLC6A4 (0.32) SLC6A4SLC6A2SLC6A3KDM4EMEN1
SCHEMBL13822733 0.89 ALDH1A1 (0.33) ALDH1A1HPGD
SCHEMBL7179766 0.88 CNR1 (0.34) SLC6A4HTR7DRD2
SCHEMBL3120852 0.87 CNR1 (0.38) SLC6A4SLC6A2MAPTHTR7DRD2
SCHEMBL3919882 0.87 KDM4E (0.41) SLC6A4SLC6A2SLC6A3KDM4EALDH1A1
SCHEMBL5983464 0.87 SLC6A4 (0.30) SLC6A4
SCHEMBL6757702 0.87
Hydrochloric Acid SCHEMBL5604483 0.86 NPC1 (0.30) MAPT
SCHEMBL4065890 0.85 HTR7 (0.32) SLC6A4SLC6A2SLC6A3KDM4EALDH1A1
Hydrochloric Acid SCHEMBL3275849 0.84 SLC6A4 (0.31) SLC6A4KDM4E

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-0812854-B2 Novel transition metal compound, olefin polymerization catalyst comprising said compound, process for olefin polymerization using said catalyst and propylene homo- and copolymer MITSUI CHEMICALS INC (JP) 2011-04-20 EP claimed
EP-1640415-B1 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS INC (JP) 2008-12-17 EP disclosed
EP-1065241-B1 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS INC (JP) 2006-04-05 EP disclosed
EP-1640415-A2 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS, INC. (JP) 2006-03-29 EP disclosed