Sugi Predict

Sugi Predict / Compounds / SCHEMBL19938436

SCHEMBL19938436

SCHEMBL19938436

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 3/20 0.44
▸ FAAH O00519 2/20 0.44
▸ PDE6D O43924 1/20 0.44
▸ CDC25A P30304 1/20 0.34
▸ CDC25B P30305 1/20 0.34
▸ CDC25C P30307 1/20 0.34
▸ ALDH1A1 P00352 4/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TAAR1 Q96RJ0 2/20 0.32
▸ PTPN1 P18031 1/20 0.32
▸ MAPK1 P28482 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 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
SCHEMBL19938563 0.89 PDE6D (0.38) MGLLFAAHPDE6DPTPN1
SCHEMBL19938211 0.88 ALDH1A1 (0.38) MGLLPDE6DALDH1A1MEN1KMT2A
SCHEMBL19938490 0.86 PDE6D (0.38) MGLLFAAHPDE6DPTPN1
SCHEMBL19939007 0.82 ALDH1A1 (0.34) MGLLFAAHPDE6DALDH1A1HSP90AA1
SCHEMBL19938304 0.81 MGLL (0.37) MGLLFAAHPDE6DALDH1A1HSP90AA1
SCHEMBL19938995 0.81 GAA (0.38) MGLLALDH1A1CES2BCHEGAA
SCHEMBL19938598 0.81 MGLL (0.48) MGLLFAAHPDE6DCDC25ACDC25B
SCHEMBL19939035 0.79 FAAH (0.32) MGLLFAAHPDE6DALDH1A1HSP90AA1
SCHEMBL22195356 0.78 MAPT (0.48) MGLLALDH1A1HTTMEN1TSHR
SCHEMBL19938314 0.78 CES2 (0.30) ALDH1A1MAPK1CES2BCHEGAA

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.