SCHEMBL5605965

SCHEMBL5605965

COc1c(C)cnc(Cn2c(=O)n(C(C)C)c3c(Cl)nc(N)nc32)c1C

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 20/20 0.60
HSP90AB1 P08238 12/20 0.60
TRAP1 Q12931 2/20 0.60
HSP90B1 P14625 1/20 0.60

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
SCHEMBL4412145 0.89 HSP90AA1 (0.62) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL5606565 0.87 HSP90AA1 (0.60) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL4415968 0.86 HSP90AA1 (0.59) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL5606034 0.86 HSP90AA1 (0.55) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL4277309 0.86 HSP90AA1 (0.55) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL4563308 0.84 HSP90AA1 (0.57) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL5606816 0.84 HSP90AA1 (0.57) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL5606650 0.84 HSP90AA1 (0.59) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL5606336 0.83 HSP90AA1 (0.59) HSP90AA1HSP90AB1TRAP1HSP90B1
SCHEMBL4268952 0.83 HSP90AA1 (0.56) 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.