SCHEMBL14618263

SCHEMBL14618263

C=C(Oc1cc(O)c(-c2cnc(S)n2-c2ccc(OC)c(N(C)C)c2)cc1C(C)C)N(C)C

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 8/20 0.38
▸ HSP90AB1 P08238 8/20 0.38
▸ FYN P06241 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
SCHEMBL1148571 0.90 HSP90AA1 (0.38) HSP90AA1HSP90AB1
SCHEMBL1147829 0.79 HSP90AA1 (0.49) HSP90AA1HSP90AB1
SCHEMBL1147983 0.77 HSP90AA1 (0.46) HSP90AA1HSP90AB1
SCHEMBL1148791 0.76 HSP90AA1 (0.35) HSP90AA1HSP90AB1FYN
SCHEMBL14525254 0.76 HSP90AA1 (0.36) HSP90AA1HSP90AB1
SCHEMBL1148633 0.75 HSP90AA1 (0.45) HSP90AA1HSP90AB1
SCHEMBL14618214 0.73 HSP90AA1 (0.38) HSP90AA1HSP90AB1
SCHEMBL3106385 0.73 HSP90AA1 (0.46) HSP90AA1HSP90AB1
SCHEMBL1148599 0.72 FGFR1 (0.39) HSP90AA1HSP90AB1
SCHEMBL1147959 0.71 HSP90AA1 (0.35) HSP90AA1HSP90AB1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007021877-A1 IMIDAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY SYNTA PHARMACEUTICALS CORP. (US) 2007-02-22 — — WO disclosed
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