SCHEMBL5601377

SCHEMBL5601377

CCCC1=c2ccccc2=C(C)[N]1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
CYP19A1 P11511 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
SCHEMBL5602154 0.88 HSD11B1 (0.37) KDM4EALDH1A1HPGD
SCHEMBL5602603 0.87 KDM4E (0.39) KDM4EALDH1A1GAAHPGDCYP19A1
SCHEMBL5600944 0.86 TDP1 (0.41) CYP19A1
SCHEMBL5601999 0.85 KCNH2 (0.43) CYP19A1
SCHEMBL5601403 0.85 KCNH2 (0.43) CYP19A1
SCHEMBL5601607 0.85 KCNH2 (0.43) CYP19A1
SCHEMBL5600971 0.85 KCNH2 (0.43) CYP19A1
SCHEMBL5601752 0.85 KCNH2 (0.43) CYP19A1
SCHEMBL5604133 0.85 KCNH2 (0.43) CYP19A1
SCHEMBL5603048 0.83 TP53 (0.33)

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