SCHEMBL17010243

SCHEMBL17010243

CCC1=Cc2ccccc2C1[Zr]C1C(CC)=Cc2ccccc21

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
HTR2A P28223 1/20 0.31
BCHE P06276 1/20 0.30
ACHE P22303 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
SCHEMBL8987416 0.82
SCHEMBL8854212 0.82 BCHE (0.37) BCHEACHE
SCHEMBL8679642 0.77
SCHEMBL5859366 0.76 CYP11B1 (0.33) CYP11B1CYP11B2HTR2A
SCHEMBL27372929 0.76 CYP11B1 (0.33) CYP11B1CYP11B2HTR2A
SCHEMBL6344924 0.76 DRD2 (0.38) CYP11B1CYP11B2HTR2A
SCHEMBL7808178 0.76 CYP11B1 (0.31) CYP11B1CYP11B2
SCHEMBL1453657 0.74 HTR2A (0.40) CYP11B1CYP11B2HTR2A
SCHEMBL7919016 0.74 KDM4E (0.33) CYP11B1CYP11B2HTR2ABCHEACHE
SCHEMBL4660518 0.74 HTR2A (0.39) CYP11B1CYP11B2HTR2A

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
EP-3105261-A1 PRODUCING POLYETHYLENE PRODUCTS WITH IMPROVED STIFFNESS, TOUGHNESS, AND PROCESSABILITY Univation Technologies, LLC (US) 2016-12-21 EP claimed
EP-3105266-A1 PRODUCING POLYOLEFIN PRODUCTS Univation Technologies, LLC (US) 2016-12-21 EP claimed
WO-2015123179-A1 PRODUCING POLYOLEFIN PRODUCTS UNIVATION TECHNOLOGIES, LLC (US) 2015-08-20 WO claimed
WO-2015123164-A1 PRODUCING POLYETHYLENE PRODUCTS WITH IMPROVED STIFFNESS, TOUGHNESS, AND PROCESSABILITY UNIVATION TECHNOLOGIES, LLC (US) 2015-08-20 WO claimed