SCHEMBL15525969

SCHEMBL15525969

[CH2]COCCn1ccc2cc(-n3c(O)nnc3-c3cc(C(C)C)c(O)cc3O)ccc21

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 20/20 0.55
HSP90AA1 P07900 19/20 0.55
HSP90B1 P14625 1/20 0.49
TRAP1 Q12931 1/20 0.49

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
SCHEMBL15525995 0.89 HSP90AA1 (0.58) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL15522262 0.88 HSP90AA1 (0.60) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL28341005 0.87 HSP90AB1 (0.53) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL15526014 0.87 HSP90AB1 (0.55) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL3415389 0.87 HSP90AA1 (0.59) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL2812277 0.87 HSP90AB1 (0.53) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL15522205 0.86 HSP90AB1 (0.51) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL16569778 0.86 HSP90AB1 (0.52) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL17099717 0.86 HSP90AA1 (0.59) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL16569776 0.85 HSP90AB1 (0.54) HSP90AB1HSP90AA1HSP90B1TRAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110559446-A Targeted therapeutics 马德里加尔制药公司 2019-12-13 CN disclosed
EP-3129064-A2 TARGETED THERAPEUTICS Synta Pharmaceuticals Corp. (US) 2017-02-15 EP disclosed
EP-3035938-A1 TARGETED THERAPEUTICS Synta Pharmaceuticals Corp. (US) 2016-06-29 EP disclosed
WO-2015134464-A2 TARGETED THERAPEUTICS SYNTA PHARMACEUTICALS CORP. (US) 2015-09-11 WO disclosed
WO-2015038649-A1 TARGETED THERAPEUTICS SYNTA PHARMACEUTICALS CORP. (US) 2015-03-19 WO disclosed
EP-2838909-A2 TARGETED THERAPEUTICS Synta Pharmaceuticals Corp. (US) 2015-02-25 EP disclosed
WO-2013158644-A2 TARGETED THERAPEUTICS SYNTA PHARMACEUTICALS CORP. (US) 2013-10-24 WO disclosed