SCHEMBL13581279

SCHEMBL13581279

CCCCCCCCC1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccc6c(c5)C(CCCCCCCC)(CCCCCCCC)c5cc(-c7ccc(C)c8nsnc78)ccc5-6)cc4)cc3)cc21

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.31

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
SCHEMBL25444719 0.96 PDK2 (0.33) PDK2
SCHEMBL25444653 0.96 ESR1 (0.30) —
SCHEMBL25444720 0.96 PDK2 (0.33) PDK2
SCHEMBL11917684 0.95 PDK2 (0.34) PDK2
SCHEMBL25444652 0.92 MMP2 (0.32) PDK2
SCHEMBL14369620 0.92 MMP2 (0.32) PDK2
SCHEMBL14701482 0.91 RARB (0.33) —
SCHEMBL13819051 0.91 CNR1 (0.31) —
SCHEMBL25444646 0.90 ESR1 (0.32) —
SCHEMBL15426047 0.90 CNR1 (0.32) —

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-8632892-B2 Organic electronic material, organic electronic device, and organic electroluminescent device HITACHI CHEMICAL CO., LTD. (JP) 2014-01-21 — — US disclosed
US-20090321723-A1 ORGANIC ELECTRONIC MATERIAL, ORGANIC ELECTRONIC DEVICE, AND ORGANIC ELECTROLUMINESCENT DEVICE HITACHI CHEMICAL COMPANY, LTD. (JP) 2009-12-31 — — 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-20090321723-A1 ORGANIC ELECTRONIC MATERIAL, ORGANIC ELECTRONIC DEVICE, AND ORGANIC ELECTROLUMINESCENT DEVICE SLCO4C1, SLCO1A2, SLCO2A1 PDK2 4490/4885

“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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