SCHEMBL8710946

SCHEMBL8710946

CC1=Cc2c(-c3ccccc3)cccc2C1[Zr](Cl)(C1C(C)=Cc2c(-c3ccccc3)cccc21)[SiH](C)C

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.30
CD274 Q9NZQ7 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
SCHEMBL5364589 0.89 PDCD1 (0.30) PDCD1CD274
SCHEMBL2525984 0.85 PDCD1 (0.33) PDCD1CD274
SCHEMBL7943368 0.84 PDCD1 (0.33) PDCD1CD274
Hydrochloric Acid SCHEMBL31386845 0.84 PDCD1 (0.33) PDCD1CD274
Hydrochloric Acid SCHEMBL30496456 0.82
SCHEMBL20496069 0.82 PDCD1 (0.31) PDCD1CD274
SCHEMBL6553568 0.82 PDCD1 (0.31) PDCD1CD274
SCHEMBL6515675 0.81
SCHEMBL5951553 0.81 PDCD1 (0.34) PDCD1CD274
SCHEMBL27493379 0.81 PDCD1 (0.34) PDCD1CD274

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-5710223-A COORDINATION POLYMERIZATION CATALYSTS FOR PROPYLENE HOMOPOLYMERS AND COPOLYMERS MITSUI PETROCHEMICAL INDUSTRIES LTD. (JP) 1998-01-20 US disclosed
EP-0629632-A2 Novel transition metal compound for use as a polymerization catalyst MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-12-21 EP disclosed