SCHEMBL22019488

SCHEMBL22019488

CP(C)(=O)c1cccc(-c2c3ccccc3c(-c3ccc(-c4c5ccccc5c(-c5cccc(P(C)(C)=O)c5)c5ccccc45)cc3)c3ccccc23)c1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.35
GRIK1 P39086 1/20 0.33
ALOX5 P09917 1/20 0.33
ESR1 P03372 3/20 0.32
ESR2 Q92731 2/20 0.32
DPP4 P27487 1/20 0.31
RPA1 P27694 1/20 0.30
MCL1 Q07820 1/20 0.30
PTPN5 P54829 1/20 0.30

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
SCHEMBL18893073 0.97 ACHE (0.37) ACHEESR1ESR2PTPN5
SCHEMBL22019274 0.96 ESR1 (0.34) ACHEGRIK1ALOX5ESR1ESR2
SCHEMBL22019265 0.95 PTPN5 (0.36) ACHEGRIK1PTPN5
SCHEMBL22020406 0.95 ESR1 (0.33) ACHEGRIK1ALOX5ESR1
SCHEMBL30980792 0.93 ACHE (0.37) ACHEGRIK1ESR1ESR2DPP4
SCHEMBL18893042 0.93 HDAC8 (0.38) ACHEGRIK1ESR1PTPN5
SCHEMBL19002149 0.93 ACHE (0.37) ACHEGRIK1ESR1ESR2DPP4
SCHEMBL22020842 0.92 HDAC8 (0.34) ACHEGRIK1MCL1
SCHEMBL23129227 0.90 ACHE (0.35) ACHEGRIK1ESR1ESR2DPP4
SCHEMBL21881902 0.89 L3MBTL1 (0.39) ESR1ESR2

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-20200161559-A1 Organic Electronic Device Comprising an Organic Semiconductor Layer NOVALED GMBH (DE) 2020-05-21 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-20200161559-A1 Organic Electronic Device Comprising an Organic Semiconductor Layer C1S, YAP1, ESR1 ACHE 1502/4885GRIK1 1679/4885ALOX5 1270/4885

“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.