Sugi Predict

Sugi Predict / Compounds / SCHEMBL19938598

SCHEMBL19938598

SCHEMBL19938598

O=P12c3c4cccc3N(c3ccc(-c5ccccc5)cc3)c3cccc(c31)N(c1ccc(-c3ccccc3)cc1)c1cccc(c12)N4c1ccc(-c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 3/20 0.48
▸ FAAH O00519 2/20 0.48
▸ PDE6D O43924 1/20 0.47
▸ CDC25A P30304 1/20 0.37
▸ CDC25B P30305 1/20 0.37
▸ CDC25C P30307 1/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ HSP90AA1 P07900 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ MAPK1 P28482 1/20 0.35
▸ CES2 O00748 1/20 0.34
▸ BCHE P06276 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ CES1 P23141 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ ENPP2 Q13822 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALOX15 P16050 1/20 0.33

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
SCHEMBL19938478 0.89 PDE6D (0.40) MGLLFAAHPDE6DCDC25ACDC25B
SCHEMBL19938219 0.88 ALDH1A1 (0.42) MGLLFAAHPDE6DALDH1A1HSP90AA1
SCHEMBL19938532 0.86 PDE6D (0.40) MGLLFAAHPDE6DCDC25ACDC25B
SCHEMBL19939063 0.82 MGLL (0.37) MGLLFAAHPDE6DALDH1A1HSP90AA1
SCHEMBL19938461 0.81 MGLL (0.41) MGLLFAAHPDE6DALDH1A1HSP90AA1
SCHEMBL19938436 0.81 MGLL (0.44) MGLLFAAHPDE6DCDC25ACDC25B
SCHEMBL19939054 0.81 ALDH1A1 (0.42) MGLLFAAHPDE6DALDH1A1HSP90AA1
SCHEMBL23139912 0.79 ALDH1A1 (0.39) MGLLFAAHPDE6DALDH1A1HSP90AA1
SCHEMBL19939096 0.79 ALDH1A1 (0.35) MGLLFAAHPDE6DALDH1A1HSP90AA1
SCHEMBL19938464 0.78 ALDH1A1 (0.33) MGLLFAAHPDE6DALDH1A1HSP90AA1

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 MGLL 3731/4885FAAH 3478/4885PDE6D 4796/4885
US-10686141-B2 Polycyclic aromatic compound ETV6, EBPL, EML4 MGLL 3731/4885FAAH 3478/4885PDE6D 4796/4885
US-20180069182-A1 POLYCYCLIC AROMATIC COMPOUND ETV6, EBPL, EML4 MGLL 3731/4885FAAH 3478/4885PDE6D 4796/4885
US-20200220083-A1 POLYCYCLIC AROMATIC COMPOUND ETV6, EBPL, EML4 MGLL 3731/4885FAAH 3478/4885PDE6D 4796/4885

“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.