SCHEMBL726973

SCHEMBL726973

[C]1CCc2ncc3ccccc3c2C1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
GPR3 P46089 1/20 0.39
TDP1 Q9NUW8 1/20 0.30
NPC1 O15118 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
SCHEMBL18576434 0.78 KDM4E (0.47) KDM4EGPR3TDP1
SCHEMBL2921118 0.75 ACHE (0.46) KDM4EGPR3TDP1
SCHEMBL8088682 0.75 ACHE (0.46) KDM4EGPR3
SCHEMBL29374271 0.75 ACHE (0.46) KDM4EGPR3TDP1
Perchlorate SCHEMBL3915050 0.68 ACHE (0.40) KDM4EGPR3TDP1
SCHEMBL637593 0.67 KDM4E (0.39) KDM4EGPR3TDP1NPC1
SCHEMBL22235378 0.65 MAPT (0.56) KDM4EGPR3
SCHEMBL976367 0.64 KDM4E (0.40) KDM4EGPR3TDP1
SCHEMBL25794200 0.64 KDM4E (0.40) KDM4EGPR3NPC1
SCHEMBL30343302 0.63 KDM4E (0.39) KDM4EGPR3TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4790184-B2 2011-10-12 JP claimed
EP-1501843-A1 ALKARYL-SUBSTITUTED GROUP 4 METAL COMPLEXES, CATALYSTS AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC. (US) 2005-02-02 EP claimed
WO-2003091265-A1 ALKARYL-SUBSTITUTED GROUP 4 METAL COMPLEXES, CATALYSTS AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC. (US) 2003-11-06 WO claimed
EP-1242471-A1 SUBSTITUTED GROUP 4 METAL COMPLEXES, CATALYSTS AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 2002-09-25 EP claimed
WO-2001042315-A1 SUBSTITUTED GROUP 4 METAL COMPLEXES, CATALYSTS AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC. (US) 2001-06-14 WO claimed