SCHEMBL5600977

SCHEMBL5600977

CCCCC(C)C1CCCC2=C1[N]c1ccccc12

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.31

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
SCHEMBL5601475 0.96 SIGMAR1 (0.30) SIGMAR1
SCHEMBL5600825 0.95 NR5A2 (0.31)
SCHEMBL5603164 0.95 NR5A2 (0.31)
SCHEMBL5603474 0.95 NR5A2 (0.31)
SCHEMBL5603505 0.95 NR5A2 (0.31)
SCHEMBL5604320 0.95 NR5A2 (0.31)
SCHEMBL5603159 0.95 NR5A2 (0.31)
SCHEMBL5603423 0.93
SCHEMBL5600266 0.87 ACE (0.33)
SCHEMBL5603153 0.82 NR1I2 (0.30)

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
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US claimed
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed