SCHEMBL12818399

SCHEMBL12818399

CCCCc1cc(CCCC)cc([Si](C2=C(C)C(C)=C(C)C2C)(c2ccccc2)c2cc(CCCC)cc(CCCC)c2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.38
PSMB5 P28074 1/20 0.36
SKP2 Q13309 1/20 0.33
HPGD P15428 2/20 0.33
NPC1 O15118 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
DHODH Q02127 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
ALDH1A1 P00352 2/20 0.31
HSD17B10 Q99714 1/20 0.31
CNR2 P34972 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 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
SCHEMBL15410253 1.00 HSD11B1 (0.38) HSD11B1PSMB5SKP2HPGDNPC1
SCHEMBL15410778 0.95 HSD11B1 (0.39) HSD11B1ALDH1A1HSD17B10KDM4ELMNA
SCHEMBL12816834 0.95 HSD11B1 (0.39) HSD11B1ALDH1A1HSD17B10KDM4ELMNA
SCHEMBL10317169 0.91 HSD11B1 (0.43) HSD11B1PSMB5HPGDDHODHTRPV1
SCHEMBL10319161 0.91 HSD11B1 (0.43) HSD11B1PSMB5HPGDDHODHTRPV1
SCHEMBL15409956 0.87 NPC1 (0.34) SKP2HPGDNPC1MAPK1HTT
SCHEMBL15410622 0.87 NPC1 (0.34) SKP2HPGDNPC1MAPK1HTT
SCHEMBL12817153 0.87 TP53 (0.32) NPC1MAPK1RAB9AALDH1A1LMNA
SCHEMBL12816672 0.87 TP53 (0.32) NPC1MAPK1RAB9AALDH1A1LMNA
SCHEMBL10321079 0.85 ESR1 (0.39) HSD11B1SKP2HPGDNPC1RAB9A

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
US-8937195-B2 Method for producing the transition metal complex, catalyst for trimerization, method for producing 1-hexene, method for producing the substituted cyclopentadiene compound (1) SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-01-20 US disclosed
EP-2691406-A1 METHOD FOR PRODUCING THE TRANSITION METAL COMPLEX, CATALYST FOR TRIMERIZATION, METHOD FOR PRODUCING 1-HEXENE, METHOD FOR PRODUCING THE SUBSTITUTED CYCLOPENTADIENE COMPOUND (1) Sumitomo Chemical Company, Limited (JP) 2014-02-05 EP disclosed
US-20140018564-A1 METHOD FOR PRODUCING THE TRANSITION METAL COMPLEX, CATALYST FOR TRIMERIZATION, METHOD FOR PRODUCING 1-HEXENE, METHOD FOR PRODUCING THE SUBSTITUTED CYCLOPENTADIENE COMPOUND (1) SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-16 US disclosed
WO-2012133924-A1 METHOD FOR PRODUCING THE TRANSITION METAL COMPLEX, CATALYST FOR TRIMERIZATION, METHOD FOR PRODUCING 1-HEXENE, METHOD FOR PRODUCING THE SUBSTITUTED CYCLOPENTADIENE COMPOUND (1) SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-04 WO disclosed