SCHEMBL4447642

SCHEMBL4447642

CCC1=C2CCC3=C(CC)C(c4ccccc43)[Zr](Cl)(Cl)C1c1ccccc12

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.30
PTGS2 P35354 1/20 0.30
HRH1 P35367 1/20 0.30
HTR3A P46098 1/20 0.30
PDE4D Q08499 1/20 0.30

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
SCHEMBL7602945 0.85 ADRA2C (0.31) ADRA2CPTGS2HRH1HTR3APDE4D
SCHEMBL797922 0.79 BCHE (0.36)
SCHEMBL4444119 0.78 ADRA2C (0.32) ADRA2CPTGS2HRH1HTR3APDE4D
SCHEMBL796322 0.76
SCHEMBL7607516 0.72 HTR2A (0.33) ADRA2CPTGS2HRH1HTR3APDE4D
SCHEMBL7598778 0.68 BRD4 (0.33)
SCHEMBL796719 0.67 BCHE (0.36)
SCHEMBL7602766 0.66 ADRA2C (0.33) ADRA2CPTGS2HRH1HTR3APDE4D
SCHEMBL797503 0.65 BCHE (0.36)
SCHEMBL7602958 0.61 HTT (0.32)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7531605-B2 Process for producing polyolefin resin composition and polypropylene composition IDEMITSU KOSAN CO., LTD. (JP) 2009-05-12 US disclosed
EP-1375538-B1 PROCESS FOR PRODUCING POLYOLEFIN RESIN COMPOSITION AND POLYPROPYLENE COMPOSITION IDEMITSU KOSAN CO (JP) 2008-01-09 EP disclosed
US-20040106738-A1 Process for producing polyolefin resin composition and polypropylene composition IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-06-03 US disclosed
EP-1375538-A1 PROCESS FOR PRODUCING POLYOLEFIN RESIN COMPOSITION AND POLYPROPYLENE COMPOSITION IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-01-02 EP disclosed