SCHEMBL19938484

SCHEMBL19938484

O=P12c3c4cccc3N(c3ccccc3)c3cc5ccccc5c(c31)N(c1ccccc1)c1c2c(cc2ccccc12)N4c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
PDE6D O43924 1/20 0.31
CES2 O00748 1/20 0.30
ALDH1A1 P00352 1/20 0.30
BCHE P06276 1/20 0.30
GAA P10253 1/20 0.30
CES1 P23141 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL19938559 0.97 CES2 (0.33) POLBPDE6DCES2ALDH1A1BCHE
SCHEMBL19938495 0.97 CES2 (0.33) POLBPDE6DCES2ALDH1A1BCHE
SCHEMBL19939121 0.92 PDE6D (0.31) POLBPDE6DCES2ALDH1A1BCHE
SCHEMBL19939123 0.92 PDE6D (0.31) POLBPDE6DCES2ALDH1A1BCHE
SCHEMBL19939097 0.90 ALDH1A1 (0.31) CES2ALDH1A1BCHEGAACES1
SCHEMBL19939073 0.89 NPEPPS (0.33) CES2ALDH1A1BCHEGAACES1
SCHEMBL19939092 0.85 GAA (0.37) CES2ALDH1A1BCHEGAACES1
SCHEMBL22096185 0.84 CYP1A2 (0.39) POLBCES2ALDH1A1BCHEGAA
SCHEMBL19938644 0.84 MEN1 (0.34) POLB
SCHEMBL19939124 0.83 CES2 (0.35) PDE6DCES2ALDH1A1BCHEGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11653565-B2 Polycyclic aromatic compound KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2023-05-16 US disclosed
US-11653565-B2 Polycyclic aromatic compound KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2023-05-16 US disclosed
US-20200220083-A1 POLYCYCLIC AROMATIC COMPOUND KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2020-07-09 US disclosed
US-10686141-B2 Polycyclic aromatic compound KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2020-06-16 US disclosed
US-20180069182-A1 POLYCYCLIC AROMATIC COMPOUND KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2018-03-08 US disclosed
US-20180069182-A1 POLYCYCLIC AROMATIC COMPOUND KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2018-03-08 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 (4 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-11653565-B2 Polycyclic aromatic compound ETV6, EBPL, EML4 POLB 2733/4885PDE6D 4796/4885CES2 2597/4885
US-10686141-B2 Polycyclic aromatic compound ETV6, EBPL, EML4 POLB 2733/4885PDE6D 4796/4885CES2 2597/4885
US-20180069182-A1 POLYCYCLIC AROMATIC COMPOUND ETV6, EBPL, EML4 POLB 2733/4885PDE6D 4796/4885CES2 2597/4885
US-20200220083-A1 POLYCYCLIC AROMATIC COMPOUND ETV6, EBPL, EML4 POLB 2733/4885PDE6D 4796/4885CES2 2597/4885

“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.