SCHEMBL4453976

SCHEMBL4453976

CC=[Zr](OCC)(OCC)(C1C=Cc2ccccc21)C1C=Cc2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.35
SIGMAR1 Q99720 6/20 0.34
RET P07949 1/20 0.33
HTR6 P50406 1/20 0.32
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 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
SCHEMBL5493956 0.79 HTR2A (0.32) HTR2ASIGMAR1
SCHEMBL819261 0.76 HTR2A (0.34) HTR2ASIGMAR1RETHTR6LMNA
SCHEMBL61249 0.75 HTR2A (0.34) HTR2ASIGMAR1RETHTR6LMNA
SCHEMBL5081369 0.74
SCHEMBL5087127 0.74 SLC6A2 (0.32)
SCHEMBL5087212 0.74 HTR1A (0.30)
SCHEMBL7899799 0.74 HTR6 (0.33) HTR2ASIGMAR1RETHTR6LMNA
SCHEMBL616106 0.72 HTR6 (0.33) HTR2ASIGMAR1RETHTR6LMNA
SCHEMBL61106 0.72 HTR6 (0.33) HTR2ASIGMAR1RETHTR6LMNA
SCHEMBL1130930 0.72 HTR6 (0.33) HTR2ASIGMAR1RETHTR6LMNA

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