SCHEMBL6697682

SCHEMBL6697682

CCCN[Zr](Cl)(Cl)(c1cccc2c1Cc1ccccc1-2)[SiH](c1ccccc1)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
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
SCHEMBL5852997 0.82 RAB9A (0.44) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL5853401 0.82 PNMT (0.34) PNMTNPC1RAB9A
SCHEMBL5853420 0.81 RAB9A (0.40) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL5853999 0.81 NPC1 (0.38) NPC1RAB9ADRD2DRD4DRD3
SCHEMBL5853085 0.80 GAA (0.39) NPC1RAB9A
SCHEMBL5855645 0.79 RAB9A (0.48) PNMTNPC1RAB9ADRD2DRD4
SCHEMBL5854769 0.79 GAA (0.40) NPC1RAB9A
SCHEMBL5854135 0.79 GAA (0.40) NPC1RAB9A
SCHEMBL5853021 0.79 NPC1 (0.36) PNMTNPC1RAB9A
SCHEMBL5856940 0.76 RAB9A (0.40) PNMTNPC1RAB9ADRD2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed