SCHEMBL7566841

SCHEMBL7566841

C[SiH](C)[Zr](Cl)(Cl)(C1C(c2ccccc2)=Cc2c(-c3ccccn3)cc(-c3ccccn3)cc21)C1C(c2ccccc2)=Cc2c(-c3ccccn3)cc(-c3ccccn3)cc21

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.31
CYP2A6 P11509 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
SCHEMBL5951409 0.87 ADRA1A (0.31) KDR
SCHEMBL7565106 0.87 KDM4E (0.33)
SCHEMBL7566516 0.86
SCHEMBL7566859 0.85 CYP1A2 (0.32)
Hydrochloric Acid SCHEMBL7566846 0.82 KDR (0.32) KDRCYP2A6
SCHEMBL7568780 0.81 CYP1A2 (0.36)
SCHEMBL7571571 0.79 KDM4E (0.30)
SCHEMBL7571196 0.78 MAOA (0.31)
SCHEMBL7564974 0.77 KDM4E (0.31)
SCHEMBL5951112 0.76 KDM4E (0.31)

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-5840947-A Organometallic compound TARGOR GMBH (DE) 1998-11-24 US claimed
EP-0743317-B1 Metallocenes comprising a heterocycle and catalysts containing them BASELL POLYOLEFINE GMBH (DE) 2002-08-28 EP disclosed
US-5840947-A Organometallic compound TARGOR GMBH (DE) 1998-11-24 US disclosed
EP-0743317-A2 Metallocenes comprising a heterocycle and catalysts containing them HOECHST AKTIENGESELLSCHAFT (DE) 1996-11-20 EP disclosed