SCHEMBL6909573

SCHEMBL6909573

CC1=Cc2c(-c3ccccc3)cccc2C1[Ti](Cl)(Cl)(=C(c1ccccc1)c1ccccc1)C1C(C)=Cc2c(-c3ccccc3)cccc21

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 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
SCHEMBL820472 0.86 PDCD1 (0.33) PDCD1CD274
SCHEMBL6902654 0.85
SCHEMBL5872680 0.81 PDCD1 (0.32) PDCD1CD274
SCHEMBL397902 0.78 PDCD1 (0.30) PDCD1CD274
SCHEMBL2535831 0.78 PDCD1 (0.30) PDCD1CD274
SCHEMBL819030 0.78 PDCD1 (0.30) PDCD1CD274
SCHEMBL6905956 0.76 MAPT (0.35)
SCHEMBL8204576 0.76 PDCD1 (0.33) PDCD1CD274
Hydrochloric Acid SCHEMBL397903 0.75 PDCD1 (0.32) PDCD1CD274
SCHEMBL6063422 0.74 BCHE (0.32) 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-6790917-B2 POLYMERIZING A VINYL COMPOUND IN PRESENCE OF A CATALYST OBTAINED BY COMBINING ORGANOTRANSITION METAL COMPOUND, AN ALUMINUM COMPUND OR ALUMOXANE AND A BORON COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-09-14 US disclosed
US-20020198340-A1 Process for producing vinyl compound polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-26 US disclosed