SCHEMBL12343777

SCHEMBL12343777

C=C1C=Cc2c(ccc(C(=O)C3CCOc4cc(OC)c(OC)cc43)c2OC)O1

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 19/20 0.38
▸ HIF1A Q16665 1/20 0.36

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 0.82 HIF1A (0.56) HIF1A
SCHEMBL4114087 0.74 MAPT (0.49) PTGDR2HIF1A
SCHEMBL29894504 0.73 CYP1A1 (0.37) PTGDR2
SCHEMBL14134371 0.72 HIF1A (0.54) HIF1A
SCHEMBL1934355 0.71 MAPK1 (0.53) PTGDR2HIF1A
SCHEMBL1934352 0.71 MAPK1 (0.53) PTGDR2HIF1A
SCHEMBL16694297 0.68 COXFA4 (0.52) PTGDR2HIF1A
SCHEMBL16867638 0.68 COXFA4 (0.52) PTGDR2HIF1A
SCHEMBL12342726 0.68 HSP90AA1 (0.34) HIF1A
SCHEMBL4124579 0.65 MAPK1 (0.45) PTGDR2HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268809-B2 Kinase inhibitors for preventing or treating pathogen infection and method of use thereof EMORY UNIVERSITY (US) 2012-09-18 — — US disclosed
US-20100249122-A1 Kinase Inhibitors for Preventing or Treating Pathogen Infection and Method of Use Thereof EMORY UNIVERSITY (US) 2010-09-30 — — 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-20100249122-A1 Kinase Inhibitors for Preventing or Treating Pathogen Infection and Method of Use Thereof MAP3K1, MAP3K2, MAP3K6 PTGDR2 3980/4885HIF1A 980/4885

“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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