SCHEMBL7034550

SCHEMBL7034550

CCC1=Cc2c(-c3ccc(C)cc3)cccc2C1[Si](C)(C)C1C(CC)=Cc2c(-c3ccc(C)cc3)cccc21

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.33
CRHR1 P34998 1/20 0.32
ENPP1 P22413 1/20 0.32
ADORA3 P0DMS8 1/20 0.31
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
MMP9 P14780 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
SCHEMBL7036422 0.89 CRHR1 (0.33) SYKCRHR1ENPP1ALDH1A1
SCHEMBL7038530 0.89 EDNRB (0.35)
SCHEMBL5836913 0.89 ADRB2 (0.33)
SCHEMBL3400108 0.88 TSHR (0.32)
SCHEMBL7031827 0.87 CRHR1 (0.32) SYKCRHR1ADORA3NPC1RAB9A
SCHEMBL7196862 0.85 SMN1; SMN2 (0.34) NPC1ALDH1A1RAB9A
SCHEMBL7201450 0.85 SYK (0.31) SYK
SCHEMBL7031437 0.85 BRD4 (0.32) MAPT
SCHEMBL7036446 0.85 S1PR1 (0.32) NPC1MAPTRAB9A
SCHEMBL7034874 0.83 HSD11B1 (0.39) NPC1ALDH1A1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6620953-B1 Complexing dimethylbis(2-methyl-4,5-benzoindenyl)silane with transition metal compounds such as 2,4-di-tert-butylphenoxide, zirconium monochloride, to form polymerization catalysts BASSELL POLYOLEFINE GMBH (DE) 2003-09-16 US disclosed
EP-1133504-B1 METHOD FOR PRODUCING MONOARYLOXY-ANSA-METALLOCENES BASELL POLYOLEFINE GMBH (DE) 2003-03-12 EP disclosed