SCHEMBL8675882

SCHEMBL8675882

CC1=Cc2ccccc2C1[Zr](Cl)(Cl)(C1C([Si](C)(C)C)=Cc2c(-c3cccc4cccnc34)cccc21)[SiH](C)C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.32

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
SCHEMBL8674306 0.93 P2RX7 (0.34) P2RX7
SCHEMBL8677011 0.90 CCR1 (0.34) P2RX7
SCHEMBL8679141 0.88 P2RX7 (0.35) P2RX7
SCHEMBL8677005 0.87 P2RX7 (0.33) P2RX7
SCHEMBL8674351 0.87 P2RX7 (0.36) P2RX7
SCHEMBL8677348 0.85 P2RX7 (0.32) P2RX7
Hydrochloric Acid SCHEMBL8675887 0.85 P2RX7 (0.31) P2RX7
SCHEMBL8674272 0.84 P2RX7 (0.34) P2RX7
SCHEMBL8675381 0.83 P2RX7 (0.35) P2RX7
Hydrochloric Acid SCHEMBL8674310 0.79 P2RX7 (0.33) P2RX7

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-5840947-A Organometallic compound TARGOR GMBH (DE) 1998-11-24 US claimed
US-5840947-A Organometallic compound TARGOR GMBH (DE) 1998-11-24 US disclosed