SCHEMBL7941677

SCHEMBL7941677

CC1=C([Si](C)(C)C)c2ccccc2C1CC1C(C)=C([Si](C)(C)C)c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.39
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
GPR3 P46089 1/20 0.31
TDO2 P48775 1/20 0.31
IDO1 P14902 1/20 0.30
PBRM1 Q86U86 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
CHRM2 P08172 1/20 0.30
HTR1A P08908 1/20 0.30
ADRA2A P08913 1/20 0.30
CHRM1 P11229 1/20 0.30
DRD1 P21728 1/20 0.30
ACHE P22303 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
ADRA1A P35348 1/20 0.30
OPRM1 P35372 1/20 0.30
DRD3 P35462 1/20 0.30
SLC6A3 Q01959 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
SCHEMBL27521611 0.77 GPR3 (0.33) GPR3IDO1
SCHEMBL7895917 0.76 GPR3 (0.32) GPR3IDO1
Hydrochloric Acid SCHEMBL27502080 0.74 GPR3 (0.31) GPR3IDO1
SCHEMBL7904186 0.71
Hydrochloric Acid SCHEMBL6911360 0.70
SCHEMBL7576966 0.70 HTR2A (0.64) HTR2ACA1CA2GPR3TDO2
SCHEMBL6911367 0.69
Hydrochloric Acid SCHEMBL6903462 0.68 POLB (0.30)
SCHEMBL6903465 0.67
SCHEMBL7645589 0.66 ALDH1A1 (0.41) HTR2ASLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6268518-B1 AS POLYMERIZATION CATALYSTS FOR POLYMERIZATION OF OLEFINS MONTELL TECHNOLOGY COMPANY B.V. (NL) 2001-07-31 US disclosed
EP-0914323-A1 METALLOCENES AND CATALYSTS FOR POLYMERIZATION OF OLEFINS Montell Technology Company B.V. (NL) 1999-05-12 EP disclosed
WO-1998043989-A1 METALLOCENES AND CATALYSTS FOR POLYMERIZATION OF OLEFINS MONTELL TECHNOLOGY COMPANY B.V. (NL) 1998-10-08 WO disclosed