SCHEMBL8077974

SCHEMBL8077974

CC1=C(C)C(C)([Zr](Oc2ccc([N+](=O)[O-])cc2)(Oc2ccc([N+](=O)[O-])cc2)C2(C)C=CC(C)=C2C)C=C1.CC1=CC(C)([Zr](Oc2ccccc2C(F)(F)F)(Oc2ccccc2C(F)(F)F)C2(C)C=C(C)C=C2C)C(C)=C1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.34
HSPB1 P04792 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
SCHEMBL5083556 0.79 HSD11B1 (0.34)
SCHEMBL5492241 0.78 HSPB1 (0.41) HSPB1
SCHEMBL5496663 0.67 TSHR (0.42)
SCHEMBL5087199 0.66 HSD11B1 (0.34)
SCHEMBL5087659 0.62 NPC1 (0.34)
SCHEMBL10987439 0.57 HSPB1 (0.46) HSPB1
SCHEMBL10988748 0.56 HSPB1 (0.53) HSPB1
SCHEMBL25191956 0.56 HSPB1 (0.56) HSPB1
Dinitrophenylene SCHEMBL11556880 0.56 TSHR (0.53) ENPP2HSPB1
SCHEMBL9497268 0.56 HSPB1 (0.51) HSPB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1035138-A1 SOLID CATALYSTS FOR THE POLYMERIZATION OF OLEFINS AND PROCESS FOR THE PRODUCTION OF OLEFIN POLYMERS THEREWITH MARUZEN PETROCHEMICAL CO., LTD. (JP) 2000-09-13 EP disclosed