SCHEMBL22862136

SCHEMBL22862136

O=C1C=CC(=O)N1c1ccccc1-c1cc(C(c2ccc(-c3ccc(C(c4ccc(N5C(=O)C=CC5=O)c(-c5ccccc5N5C(=O)C=CC5=O)c4)c4ccc(N5C(=O)C=CC5=O)c(-c5ccccc5N5C(=O)C=CC5=O)c4)cc3)cc2)c2ccc(N3C(=O)C=CC3=O)c(-c3ccccc3N3C(=O)C=CC3=O)c2)ccc1N1C(=O)C=CC1=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 13/20 0.53
TLR9 Q9NR96 3/20 0.46
FAAH O00519 3/20 0.41
ALDH1A1 P00352 3/20 0.37
HSP90AA1 P07900 3/20 0.37
ATM Q13315 3/20 0.37
HTT P42858 2/20 0.37
PKM P14618 2/20 0.37
NPSR1 Q6W5P4 2/20 0.36
MITF O75030 1/20 0.36
CCR6 P51684 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PDE6D O43924 1/20 0.35
NR1H3 Q13133 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
SCHEMBL22862131 0.97 MGLL (0.58) MGLLTLR9FAAHALDH1A1HSP90AA1
SCHEMBL22862185 0.88 MGLL (0.57) MGLLTLR9FAAHALDH1A1HSP90AA1
SCHEMBL22862093 0.88 MGLL (0.57) MGLLTLR9FAAHALDH1A1HSP90AA1
SCHEMBL22862149 0.86 MGLL (0.40) MGLLTLR9FAAHALDH1A1HSP90AA1
SCHEMBL6832688 0.77 TLR9 (0.76) MGLLTLR9FAAHALDH1A1HSP90AA1
SCHEMBL22862045 0.75 MGLL (0.54) MGLLTLR9FAAHALDH1A1HSP90AA1
SCHEMBL9719950 0.75 MGLL (0.88) MGLLTLR9FAAHALDH1A1HSP90AA1
SCHEMBL28616908 0.75 MGLL (0.73) MGLLTLR9FAAHALDH1A1HSP90AA1
SCHEMBL22862071 0.73 TLR9 (0.59) MGLLTLR9FAAHALDH1A1HSP90AA1
SCHEMBL14089623 0.73 PDE6D (0.44) MGLLFAAHALDH1A1ATMHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210003921-A1 COMPOUND, RESIN, COMPOSITION, AND FILM FORMING MATERIAL FOR LITHOGRAPHY USING THE SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-01-07 US disclosed
EP-3760611-A1 COMPOUND, RESIN, COMPOSITION AND FILM-FORMING MATERIAL FOR LITHOGRAPHY USING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-01-06 EP 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-20210003921-A1 COMPOUND, RESIN, COMPOSITION, AND FILM FORMING MATERIAL FOR LITHOGRAPHY USING THE SAME COL1A1, MLLT3, F12 MGLL 1551/4885TLR9 2020/4885FAAH 2256/4885

“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.