SCHEMBL19998918

SCHEMBL19998918

Cc1ccc(-c2cc(-c3ccc(C)cc3)cc(-c3ccc(N(c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)cc3)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 16/20 0.45
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
PTPRC P08575 1/20 0.33
HPRT1 P00492 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL19269567 0.97 PDK2 (0.47) PDK2ESR1ESR2PTPRCMEN1
SCHEMBL14597177 0.97 PDK2 (0.47) PDK2ESR1ESR2PTPRCMEN1
SCHEMBL14183688 0.94 PDK2 (0.45) PDK2ESR1ESR2PTPRCHPRT1
SCHEMBL18910342 0.94 PDK2 (0.45) PDK2ESR1ESR2PTPRCHPRT1
SCHEMBL17998534 0.94 PDK2 (0.45) PDK2ESR1ESR2PTPRCHPRT1
SCHEMBL6374341 0.94 PDK2 (0.45) PDK2ESR1ESR2PTPRCHPRT1
SCHEMBL10820310 0.93 PDK2 (0.41) PDK2ESR1ESR2PTPRCMEN1
SCHEMBL22053434 0.93 PDK2 (0.41) PDK2ESR1ESR2PTPRCMEN1
SCHEMBL14183694 0.93 PDK2 (0.41) PDK2ESR1ESR2PTPRCMEN1
SCHEMBL10038925 0.93 PDK2 (0.41) PDK2ESR1ESR2PTPRCMEN1

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-20180090687-A1 CROSS-CONJUGATED POLYMER, MATERIAL FOR ELECTRONIC ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD (JP) 2018-03-29 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-20180090687-A1 CROSS-CONJUGATED POLYMER, MATERIAL FOR ELECTRONIC ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT SLC18A1, SLC1A2, SLC43A1 PDK2 1167/4885ESR1 253/4885ESR2 389/4885

“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.