SCHEMBL22541320

SCHEMBL22541320

[N-]=[N+]=NCCOCCOCCNC(=O)CCC(=O)NN

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 8/20 0.39
▸ CA9 Q16790 7/20 0.39
▸ CA12 O43570 6/20 0.39
▸ CA1 P00915 6/20 0.39
▸ CA4 P22748 6/20 0.39
▸ CA14 Q9ULX7 6/20 0.39
▸ CRBN Q96SW2 3/20 0.38
▸ GAA P10253 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.34
▸ KDM5C P41229 1/20 0.34
▸ PHF8 Q9UPP1 1/20 0.34
▸ KDM2A Q9Y2K7 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TTR P02766 1/20 0.31
▸ CTSD P07339 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL17282361 0.92 CRBN (0.41) CA2CA9CA12CA1CA4
SCHEMBL18886281 0.92 CRBN (0.41) CA2CA9CA12CA1CA4
SCHEMBL19138454 0.88 CA2 (0.39) CA2CA9CA12CA1CA4
SCHEMBL20883229 0.87 CRBN (0.39) CA2CA9CA12CA1CA4
SCHEMBL20552921 0.87 CRBN (0.39) CA2CA9CA12CA1CA4
SCHEMBL23157563 0.87 CRBN (0.39) CA2CA9CA12CA1CA4
SCHEMBL23157517 0.87 CRBN (0.39) CA2CA9CA12CA1CA4
SCHEMBL30737963 0.86 GAA (0.41) CRBNGAAKDM4EKDM5CPHF8
SCHEMBL29496150 0.86 GAA (0.41) CRBNGAAKDM4EKDM5CPHF8
SCHEMBL26617637 0.85 CRBN (0.37) CA2CA9CA12CA1CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220168435-A1 PROGRAMMABLE POLYMERIC DRUGS SONY CORPORATION (JP) 2022-06-02 — — US disclosed
US-20220168433-A1 PROGRAMMABLE POLYMERIC DRUGS Sony Group Corporation (JP) 2022-06-02 — — US disclosed
US-20220160887-A1 PROGRAMMABLE POLYMERIC DRUGS Sony Group Corporation (JP) 2022-05-26 — — US disclosed
WO-2020210692-A1 PROGRAMMABLE POLYMERIC DRUGS SONY CORPORATION (JP) 2020-10-15 — — WO disclosed
WO-2020210694-A1 PROGRAMMABLE POLYMERIC DRUGS SONY CORPORATION (JP) 2020-10-15 — — WO 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 (3 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-20220160887-A1 PROGRAMMABLE POLYMERIC DRUGS CHRM1, NCL, PBRM1 CA2 2294/4885CA9 3351/4885CA12 2584/4885
US-20220168433-A1 PROGRAMMABLE POLYMERIC DRUGS CHRM1, PBRM1, CHRM2 CA2 2260/4885CA9 3033/4885CA12 2163/4885
US-20220168435-A1 PROGRAMMABLE POLYMERIC DRUGS CHRM1, PBRM1, CHRM2 CA2 2274/4885CA9 3038/4885CA12 2169/4885

“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.

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