SCHEMBL5603221

SCHEMBL5603221

CCCCCCCCCCCC(C)c1cccc2c1[N]c1ccccc1-2

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.33
SOAT1 P35610 1/20 0.33
PTPN1 P18031 1/20 0.32
KCNH2 Q12809 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
CSNK1E P49674 1/20 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
SCHEMBL5601725 1.00 PPARG (0.33) PPARGSOAT1PTPN1KCNH2ALDH1A1
SCHEMBL5601848 1.00 PPARG (0.33) PPARGSOAT1PTPN1KCNH2ALDH1A1
SCHEMBL5600984 1.00 PPARG (0.33) PPARGSOAT1PTPN1KCNH2ALDH1A1
SCHEMBL5601221 1.00 PPARG (0.33) PPARGSOAT1PTPN1KCNH2ALDH1A1
SCHEMBL5600989 1.00 PPARG (0.33) PPARGSOAT1PTPN1KCNH2ALDH1A1
SCHEMBL5600509 0.99 PPARG (0.31) PPARGSOAT1PTPN1ALDH1A1
SCHEMBL5601838 0.94 TSHR (0.31) ALDH1A1
SCHEMBL5602137 0.88 TSHR (0.33) ALDH1A1
SCHEMBL5600727 0.82 TSHR (0.46) ALDH1A1
SCHEMBL5603938 0.81 SOAT1 (0.32) SOAT1KCNH2ALDH1A1GPR84CSNK1E

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