SCHEMBL5606408

SCHEMBL5606408

Cc1cnc(Cn2c(=O)n(CCN3CCN(C)CC3)c3c(Cl)nc(N)nc32)c(C)c1I

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 20/20 0.51
▸ HSP90AB1 P08238 16/20 0.51
▸ TRAP1 Q12931 2/20 0.39
▸ HSP90B1 P14625 1/20 0.39

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
SCHEMBL4429509 0.88 HSP90AA1 (0.45) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL5605929 0.88 HSP90AA1 (0.53) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL14392852 0.87 HSP90AA1 (0.56) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL4269186 0.86 HSP90AA1 (0.55) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL5606076 0.85 HSP90AA1 (0.52) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL14366739 0.83 HSP90AA1 (0.59) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL4273900 0.82 HSP90AA1 (0.51) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL5606328 0.82 HSP90AA1 (0.51) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL4419599 0.82 HSP90AA1 (0.61) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL14366751 0.82 HSP90AA1 (0.51) HSP90AA1HSP90AB1TRAP1HSP90B1

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
US-20070253896-A1 7,9-Dihydro-Purin-8-One and Related Analogs as HSP90-Inhibitors CONFORMA THERAPEUTICS CORPORATION (US) 2007-11-01 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070253896-A1 7,9-Dihydro-Purin-8-One and Related Analogs as HSP90-Inhibitors HSP90B1, HSP90AB2P, HSP90AB1 HSP90AA1 4/4885HSP90AB1 3/4885TRAP1 14/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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