SCHEMBL7036307

SCHEMBL7036307

CCCC1=Cc2c(-c3ccc(CCC)cc3)cccc2C1[Si](C)(C)C1C(CCC)=Cc2c(-c3ccc(CCC)cc3)cccc21

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.32
NISCH Q9Y2I1 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
GFER P55789 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
SCHEMBL7037024 0.94 HSD11B1 (0.34) S1PR1NISCHNPC1MAPTRAB9A
SCHEMBL7037707 0.94 HSD11B1 (0.36) S1PR1NISCHNPC1MAPTRAB9A
SCHEMBL7036446 0.94 S1PR1 (0.32) S1PR1NISCHNPC1MAPTRAB9A
SCHEMBL7036530 0.94 EDNRB (0.33)
SCHEMBL7039771 0.92 HSD11B1 (0.37) MAPTRAB9A
SCHEMBL7031378 0.90 HSD11B1 (0.37) S1PR1NISCHNPC1MAPTRAB9A
SCHEMBL7036422 0.90 CRHR1 (0.33)
SCHEMBL7196689 0.89 S1PR1 (0.32) S1PR1
SCHEMBL7039008 0.87 S1PR1 (0.32) S1PR1NISCHNPC1MAPTRAB9A
SCHEMBL7031849 0.87 HSD11B1 (0.37) MAPTRAB9A

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