SCHEMBL8211802

SCHEMBL8211802

CC1=C(c2ccccc2)CC(Cl)=C1[SiH2]C1=C(Cl)CC(c2ccccc2)=C1C.[Zr]

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.35
GOPC Q9HD26 1/20 0.35
CYP1A2 P05177 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
SCHEMBL8220520 0.96 CFTR (0.35) CFTRGOPCCYP1A2
SCHEMBL28383000 0.66 CFTR (0.44) CFTRGOPC
SCHEMBL8211783 0.63
SCHEMBL27933484 0.63 CFTR (0.41) CFTRGOPC
SCHEMBL6903149 0.63 CYP1A2 (0.32) CYP1A2
SCHEMBL31608569 0.62 CYP17A1 (0.47) CFTRGOPC
SCHEMBL19019874 0.62 CYP17A1 (0.47) CFTRGOPC
SCHEMBL868869 0.61 CFTR (0.68) CFTRGOPCCYP1A2
SCHEMBL27519772 0.60 NPC1 (0.36) CFTRGOPCCYP1A2
SCHEMBL27949026 0.59 PTGS2 (0.42) CFTRGOPC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6110858-A AN OLEFIN POLYMERIZATION CATALYST CONSISTS OF A TRANSITION METAL COMPOUND, A MODIFIED CLAY COMPOUND CONTAINING CLAY MINERAL AND AN AMINE COMPOUND AND AN ORGANOALUMINUM COMPOUND TOSOH CORPORATION (JP) 2000-08-29 US disclosed
EP-0849292-A1 Olefin polymerisation catalysts and processes for producing olefin polymers TOSOH CORPORATION (JP) 1998-06-24 EP disclosed