SCHEMBL6064840

SCHEMBL6064840

CC1=Cc2cc(-n3ccc4ccccc43)cc(N3c4ccccc4Sc4cccc(O)c43)c2C1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.31

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
SCHEMBL5602850 0.90 BIRC5 (0.34)
SCHEMBL6064252 0.86 HSP90AA1 (0.33) HSP90AA1
SCHEMBL6064959 0.81 ALDH1A1 (0.35)
SCHEMBL6065338 0.80 NOX1 (0.35)
SCHEMBL6064976 0.78 BCHE (0.33)
SCHEMBL5603133 0.74 BIRC5 (0.35) HSP90AA1
SCHEMBL6065398 0.72 NOX1 (0.36)
SCHEMBL3690934 0.71 BIRC5 (0.36) HSP90AA1
SCHEMBL5600473 0.70 BIRC5 (0.35)
SCHEMBL14380203 0.69 BIRC5 (0.35)

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
EP-1735354-A1 HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION Exxonmobil Chemical Company Inc. (US) 2006-12-27 EP disclosed
WO-2005105864-A1 HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-11-10 WO disclosed