SCHEMBL4444119

SCHEMBL4444119

CC1=C2CCC3=C(C)C(c4ccccc43)[Zr](Cl)(Cl)C1c1ccccc12

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.32
PTGS2 P35354 1/20 0.32
HRH1 P35367 1/20 0.32
HTR3A P46098 1/20 0.32
PDE4D Q08499 1/20 0.32
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
NCOR2 Q9Y618 1/20 0.31
GPR3 P46089 1/20 0.31
POLB P06746 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
SCHEMBL7602766 0.84 ADRA2C (0.33) ADRA2CPTGS2HRH1HTR3APDE4D
SCHEMBL6895735 0.79 ADRA2C (0.32) ADRA2CPTGS2HRH1HTR3APDE4D
SCHEMBL4447642 0.78 ADRA2C (0.30) ADRA2CPTGS2HRH1HTR3APDE4D
SCHEMBL797503 0.74 BCHE (0.36)
SCHEMBL797367 0.74 PBRM1 (0.32) HDAC3HDAC4HDAC7HDAC8HDAC6
SCHEMBL4453778 0.69 PTGS2 (0.33) PTGS2
Hydrochloric Acid SCHEMBL218728 0.69 ADRA2C (0.36) ADRA2CPTGS2HRH1HTR3APDE4D
SCHEMBL7607809 0.69 ADRA2C (0.33) ADRA2CPTGS2HRH1HTR3APDE4D
Hydrochloric Acid SCHEMBL5616595 0.69 ADRA2C (0.33) ADRA2CPTGS2HRH1HTR3APDE4D
Hydrochloric Acid SCHEMBL218502 0.69 ADRA2C (0.33) ADRA2CPTGS2HRH1HTR3APDE4D

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