SCHEMBL6449300

SCHEMBL6449300

C[Si](C)(CCO)[Zr](C)(=O)([SiH3])(Cl)(Cl)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
PNMT P11086 1/20 0.35
HTR7 P34969 1/20 0.33
HTR2B P41595 1/20 0.33
DRD2 P14416 2/20 0.30
DRD4 P21917 2/20 0.30
DRD3 P35462 2/20 0.30
MTNR1A P48039 1/20 0.30
MTNR1B P49286 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
SCHEMBL6440131 0.74 PNMT (0.41) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL6446170 0.71 NPC1 (0.38) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL3124500 0.70 PNMT (0.44) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL7766804 0.66 PNMT (0.46) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL8676462 0.65 NPC1 (0.40) NPC1RAB9A
SCHEMBL7930906 0.65 PNMT (0.45) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL6671922 0.63 PNMT (0.49) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL8086440 0.62 PNMT (0.49) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL7770505 0.62 PNMT (0.41) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL30103334 0.61 PNMT (0.63) NPC1RAB9APNMTHTR7HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050065018-A1 Preparation and use of heterogeneous catalyst components for olefins polymerization (1) REPSOL QUIMICA S.A. 2005-03-24 US disclosed
EP-0953580-B1 Preparation and use of heterogeneous catalyst components for olefins polymerization REPSOL QUIMICA SA (ES) 2004-04-14 EP disclosed
US-20030144135-A1 PREPARATION AND USE OF HETEROGENEOUS CATALYST COMPONENTS FOR OLEFINS POLYMERIZATION REPSOL QUIMICA S.A. (ES) 2003-07-31 US disclosed
EP-0955306-B1 Functionalized metallocene compounds, synthesis process and use thereof REPSOL QUIMICA SA (ES) 2003-01-22 EP disclosed
US-6114555-A Functionalized metallocene compounds, synthesis process and use thereof REPSOL QUIMICA S.A. (ES) 2000-09-05 US disclosed
EP-0955306-A1 Functionalized metallocene compounds, synthesis process and use thereof REPSOL QUIMICA S.A. (ES) 1999-11-10 EP disclosed
EP-0953580-A1 Preparation and use of heterogeneous catalyst components for olefins polymerization REPSOL QUIMICA S.A. (ES) 1999-11-03 EP disclosed