SCHEMBL7694030

SCHEMBL7694030

C=CCC1=Cc2sccc2C1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.30
NOS2 P35228 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
SCHEMBL7690191 0.72
SCHEMBL7693323 0.69
SCHEMBL7694833 0.69
SCHEMBL5859274 0.68 ACHE (0.45)
Hydrochloric Acid SCHEMBL31564483 0.64 NOS3 (0.33) NOS3NOS2
SCHEMBL7694255 0.64
SCHEMBL7692201 0.63
SCHEMBL6526497 0.63 GABRA1 (0.32)
Hydrochloric Acid SCHEMBL5583522 0.63 DRD2 (0.33)
SCHEMBL7691601 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6469114-B1 TO AVOID DEPOSIT FORMATION IN THE REACTOR, SUPPORTED CATALYST SYSTEMS IN WHICH THE METALLOCENE AND/OR THE ALUMINUM COMPOUNDS SERVING AS COCATALYST ARE FIXED ON AN INORGANIC SUPPORT MATERIAL HAVE BEEN PROPOSED BASELL POLYOLEFINS GMBH (DE) 2002-10-22 US claimed
EP-1082363-A1 ORGANOMETAL COMPOUND, CATALYST SYSTEM CONTAINING SAID ORGANOMETAL COMPOUND AND ITS USE Basell Polyolefine GmbH (DE) 2001-03-14 EP claimed
WO-2000044799-A1 ORGANOMETAL COMPOUND, CATALYST SYSTEM CONTAINING SAID ORGANOMETAL COMPOUND AND ITS USE TARGOR GMBH (DE) 2000-08-03 WO claimed
US-6469114-B1 TO AVOID DEPOSIT FORMATION IN THE REACTOR, SUPPORTED CATALYST SYSTEMS IN WHICH THE METALLOCENE AND/OR THE ALUMINUM COMPOUNDS SERVING AS COCATALYST ARE FIXED ON AN INORGANIC SUPPORT MATERIAL HAVE BEEN PROPOSED BASELL POLYOLEFINS GMBH (DE) 2002-10-22 US disclosed
EP-1082363-A1 ORGANOMETAL COMPOUND, CATALYST SYSTEM CONTAINING SAID ORGANOMETAL COMPOUND AND ITS USE Basell Polyolefine GmbH (DE) 2001-03-14 EP disclosed
WO-2000044799-A1 ORGANOMETAL COMPOUND, CATALYST SYSTEM CONTAINING SAID ORGANOMETAL COMPOUND AND ITS USE TARGOR GMBH (DE) 2000-08-03 WO disclosed