SCHEMBL9943635

SCHEMBL9943635

CC[Zr](=[SiH2])(CC)(C1=CC=CC1)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.38
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
DRD3 P35462 1/20 0.32

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
Hydrochloric Acid SCHEMBL5081173 0.99 PNMT (0.37) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL5079479 0.89 PNMT (0.35) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL5079549 0.87 PNMT (0.34) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL5077711 0.86 PNMT (0.35) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL7641528 0.84 PNMT (0.45) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL8855722 0.83 NPC1 (0.39) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL814187 0.82 NPC1 (0.38) PNMTNPC1RAB9ADRD2DRD4
Hydrochloric Acid SCHEMBL7082520 0.80 NPC1 (0.36) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL8978029 0.80 NPC1 (0.36) PNMTNPC1RAB9A
Hydrochloric Acid SCHEMBL5081177 0.80 NPC1 (0.34) PNMTNPC1RAB9A

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
EP-2511305-A1 Bridged metallocene compound for olefin polymerization and method of polymerizing olefin using the same Mitsui Chemicals, Inc. (JP) 2012-10-17 EP disclosed
EP-2465878-A1 Bridged metallocene compound for olefin polymerization and method of polymerizing olefin using the same Mitsui Chemicals, Inc. (JP) 2012-06-20 EP disclosed
EP-2465879-A1 Bridged metallocene compound for olefin polymerization and method of polymerizing olefin using the same Mitsui Chemicals, Inc. (JP) 2012-06-20 EP disclosed