SCHEMBL6904518

SCHEMBL6904518

Cl[Ti](Cl)C(Cc1cccc2c1Cc1ccccc1-2)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.51
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
HTR7 P34969 1/20 0.32
HTR2B P41595 1/20 0.32
HSP90AA1 P07900 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
SCHEMBL5357886 0.79 PNMT (0.53) PNMTDRD2DRD4DRD3NPC1
SCHEMBL7609044 0.78 PNMT (0.59) PNMTDRD2DRD4DRD3NPC1
SCHEMBL7603809 0.78 PNMT (0.55) PNMTDRD2DRD4DRD3NPC1
SCHEMBL6557933 0.78 PNMT (0.55) PNMTDRD2DRD4DRD3NPC1
SCHEMBL1539790 0.78 PNMT (0.55) PNMTDRD2DRD4DRD3NPC1
SCHEMBL5357562 0.78 PNMT (0.51) PNMTDRD2DRD4DRD3NPC1
SCHEMBL5348067 0.78 PNMT (0.51) PNMTDRD2DRD4DRD3NPC1
SCHEMBL7604159 0.77 PNMT (0.54) PNMTDRD2DRD4DRD3NPC1
Hydrochloric Acid SCHEMBL7607175 0.76 PNMT (0.53) PNMTDRD2DRD4DRD3NPC1
SCHEMBL28836883 0.74 PNMT (0.62) PNMTDRD2DRD4DRD3NPC1

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-0996647-B1 PROCESS FOR THE PRODUCTION OF OLEFIN POLYMERS HAVING A DESIRABLE MOLECULAR WEIGHT DISTRIBUTION BOREALIS TECH OY (FI) 2004-09-08 EP disclosed
EP-0996647-A1 PROCESS FOR THE PRODUCTION OF OLEFIN POLYMERS HAVING A DESIRABLE MOLECULAR WEIGHT DISTRIBUTION BOREALIS A/S (DK) 2000-05-03 EP disclosed
WO-1999003897-A1 PROCESS FOR THE PRODUCTION OF OLEFIN POLYMERS HAVING A DESIRABLE MOLECULAR WEIGHT DISTRIBUTION BOREALIS A/S (DK) 1999-01-28 WO disclosed