SCHEMBL5602070

SCHEMBL5602070

CCCCCC1=c2ccccc2=C[P]1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.36
KCNH2 Q12809 3/20 0.35
TYR P14679 1/20 0.34
ALOX5 P09917 1/20 0.33
PTGS2 P35354 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
PTPN1 P18031 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
HTR2A P28223 1/20 0.32

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
SCHEMBL5603818 0.98 LIPG (0.39) LIPGKCNH2TYRPTGS2PTPN1
SCHEMBL5601800 0.98 LIPG (0.39) LIPGKCNH2TYRPTGS2PTPN1
SCHEMBL5602808 0.98 LIPG (0.39) LIPGKCNH2TYRPTGS2PTPN1
SCHEMBL5601532 0.98 LIPG (0.39) LIPGKCNH2TYRPTGS2PTPN1
SCHEMBL5603262 0.98 LIPG (0.39) LIPGKCNH2TYRPTGS2PTPN1
SCHEMBL5602084 0.87
SCHEMBL5603887 0.75 KCNH2 (0.42) LIPGKCNH2PTGS2TDP1L3MBTL1
SCHEMBL5603147 0.73 KCNH2 (0.44) LIPGKCNH2PTGS2PTPN1GPR84
SCHEMBL5600057 0.70 ALDH1A1 (0.31)
SCHEMBL5602218 0.69 ALDH1A1 (0.33) GPR84

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