SCHEMBL14134371

SCHEMBL14134371

COc1c(C(=O)C2CCOc3cc(CO)c(CO)cc32)ccc2c1C=CC(C)(C)O2

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 17/20 0.54
▸ HSP90AA1 P07900 4/20 0.52

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
SCHEMBL11939511 0.89 HIF1A (0.56) HIF1AHSP90AA1
SCHEMBL16867638 0.72 COXFA4 (0.52) HIF1AHSP90AA1
SCHEMBL16694297 0.72 COXFA4 (0.52) HIF1AHSP90AA1
SCHEMBL12343777 0.72 PTGDR2 (0.38) HIF1A
SCHEMBL18244727 0.71 HIF1A (1.00) HIF1AHSP90AA1
SCHEMBL14134344 0.70 HIF1A (0.51) HIF1AHSP90AA1
SCHEMBL21752804 0.70 HIF1A (0.70) HIF1AHSP90AA1
SCHEMBL21765950 0.70 HIF1A (0.67) HIF1AHSP90AA1
SCHEMBL30860405 0.70 HIF1A (0.70) HIF1AHSP90AA1
SCHEMBL16865490 0.70 COXFA4 (0.49) HIF1AHSP90AA1

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-20120302565-A1 KINASE INHIBITORS FOR PREVENTING OR TREATING PATHOGEN INFECTION AND METHOD OF USE THEREOF M.D. ANDERSON CANCER CENTER (US) 2012-11-29 — — 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-20120302565-A1 KINASE INHIBITORS FOR PREVENTING OR TREATING PATHOGEN INFECTION AND METHOD OF USE THEREOF MAP3K1, MAP3K2, MAP3K6 HIF1A 980/4885HSP90AA1 625/4885

“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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