SCHEMBL5601481

SCHEMBL5601481

Br[Zr](Br)(C1C(n2ccc3ccccc32)=Cc2ccccc21)C1C(n2ccc3ccccc32)=Cc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BIRC5 O15392 1/20 0.36
PRKD3 O94806 1/20 0.36
PRKCG P05129 1/20 0.36
PRKCB P05771 1/20 0.36
PRKCA P17252 1/20 0.36
PRKACA P17612 1/20 0.36
PRKACG P22612 1/20 0.36
PRKACB P22694 1/20 0.36
PRKCH P24723 1/20 0.36
PRKCI P41743 1/20 0.36
PRKCE Q02156 1/20 0.36
PRKCQ Q04759 1/20 0.36
PRKCZ Q05513 1/20 0.36
PRKCD Q05655 1/20 0.36
PRKD1 Q15139 1/20 0.36
CDC7 O00311 1/20 0.33
CDK2 P24941 1/20 0.33
ROCK1 Q13464 1/20 0.33
CDK4 P11802 1/20 0.31
CCND1 P24385 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
SCHEMBL5601922 0.86 BIRC5 (0.40) BIRC5PRKD3PRKCGPRKCBPRKCA
SCHEMBL5603231 0.86 BIRC5 (0.36) BIRC5PRKD3PRKCGPRKCBPRKCA
SCHEMBL5603962 0.78 BIRC5 (0.34) BIRC5PRKD3PRKCGPRKCBPRKCA
SCHEMBL5601499 0.77 BIRC5 (0.33) BIRC5PRKD3PRKCGPRKCBPRKCA
SCHEMBL5602822 0.77 BIRC5 (0.31) BIRC5PRKD3PRKCGPRKCBPRKCA
SCHEMBL5601336 0.77 MAPT (0.33)
SCHEMBL5600271 0.76 BIRC5 (0.32) BIRC5
Hydrochloric Acid SCHEMBL5601147 0.75 BIRC5 (0.37) BIRC5PRKD3PRKCGPRKCBPRKCA
Hydrochloric Acid SCHEMBL5603156 0.75 BIRC5 (0.41) BIRC5PRKD3PRKCGPRKCBPRKCA
Fluoride Ion SCHEMBL5603224 0.75 BIRC5 (0.37) BIRC5PRKD3PRKCGPRKCBPRKCA

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 2 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 disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed