SCHEMBL19938461

SCHEMBL19938461

O=P12c3c4cc(-c5ccccc5)cc3N(c3ccccc3)c3cc(-c5ccccc5)cc(c31)N(c1ccccc1)c1cc(-c3ccccc3)cc(c12)N4c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.41
ALDH1A1 P00352 4/20 0.41
FAAH O00519 2/20 0.41
HSP90AA1 P07900 2/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.41
GAA P10253 3/20 0.35
CES2 O00748 1/20 0.34
BCHE P06276 1/20 0.34
CES1 P23141 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PDE6D O43924 1/20 0.34
GLO1 Q04760 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ENPP2 Q13822 1/20 0.33
HPGD P15428 1/20 0.33
MAPT P10636 1/20 0.33
GFER P55789 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL19939063 0.89 MGLL (0.37) MGLLALDH1A1FAAHHSP90AA1PKM
SCHEMBL19939096 0.85 ALDH1A1 (0.35) MGLLALDH1A1FAAHHSP90AA1PKM
SCHEMBL19938598 0.81 MGLL (0.48) MGLLALDH1A1FAAHHSP90AA1PKM
SCHEMBL19938304 0.81 MGLL (0.37) MGLLALDH1A1FAAHHSP90AA1PKM
SCHEMBL19938219 0.80 ALDH1A1 (0.42) MGLLALDH1A1FAAHHSP90AA1PKM
SCHEMBL19938463 0.78 MGLL (0.31) MGLL
SCHEMBL19939110 0.78
SCHEMBL19939081 0.78
SCHEMBL19938494 0.77 OPRK1 (0.38) MGLLALDH1A1HTTGAACES2
SCHEMBL19938476 0.77 MDM2 (0.34) MGLLFAAH

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 3731/4885ALDH1A1 3566/4885FAAH 3478/4885
US-10686141-B2 Polycyclic aromatic compound ETV6, EBPL, EML4 MGLL 3731/4885ALDH1A1 3566/4885FAAH 3478/4885
US-20180069182-A1 POLYCYCLIC AROMATIC COMPOUND ETV6, EBPL, EML4 MGLL 3731/4885ALDH1A1 3566/4885FAAH 3478/4885
US-20200220083-A1 POLYCYCLIC AROMATIC COMPOUND ETV6, EBPL, EML4 MGLL 3731/4885ALDH1A1 3566/4885FAAH 3478/4885

“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.