SCHEMBL21643199

SCHEMBL21643199

O=C(Cc1ccc(F)cc1)Nc1ccc(C(OC(=O)O)c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.57
▸ MEN1 O00255 5/20 0.57
▸ KMT2A Q03164 5/20 0.57
▸ MAPT P10636 3/20 0.57
▸ HTT P42858 2/20 0.57
▸ GAA P10253 3/20 0.54
▸ MAOA P21397 1/20 0.51
▸ MAOB P27338 1/20 0.51
▸ MAPK1 P28482 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ EGFR P00533 1/20 0.48
▸ CA12 O43570 1/20 0.48
▸ CA1 P00915 1/20 0.48
▸ CA2 P00918 1/20 0.48
▸ CA9 Q16790 1/20 0.48
▸ MMP1 P03956 1/20 0.47
▸ MMP2 P08253 1/20 0.47
▸ MMP9 P14780 1/20 0.47
▸ MMP8 P22894 1/20 0.47

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
SCHEMBL4072685 0.77 MEN1 (0.60) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL27841700 0.76 MEN1 (0.74) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL20467625 0.75 ALDH1A1 (0.65) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL10012491 0.75 TGM2 (0.70) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL4628679 0.74 KMT2A (0.71) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL4733997 0.73 KMT2A (1.00) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL5657581 0.73 MEN1 (0.70) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL6639523 0.73 CES2 (0.50) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL23497984 0.72 MEN1 (0.49) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL18416955 0.71 MEN1 (0.71) ALDH1A1MEN1KMT2AMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118256591-A Cyclic peptide compound having high membrane permeability and library comprising same 中外制药株式会社 2024-06-28 — — CN disclosed
CN-110869544-B Cyclic peptide compound having high membrane permeability and library comprising same 中外制药株式会社 2024-03-08 — — CN disclosed
US-20230108274-A1 COMPOSITION FOR TRANSLATION, AND METHOD FOR PRODUCING PEPTIDE CHUGAI PHARMACEUTICAL CO LTD (JP) 2023-04-06 — — US disclosed
US-20230069218-A1 METHOD FOR PRODUCING PEPTIDE CONTAINING NON-NATURAL AMINO ACID CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-03-02 — — US disclosed
CN-115667539-A Translation system with altered genetic code tables 中外制药株式会社 2023-01-31 — — CN disclosed
EP-4026906-A1 COMPOSITION FOR TRANSLATION, AND METHOD FOR PRODUCING PEPTIDE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-07-13 — — EP disclosed
CN-114641569-A Composition for translation and method for producing peptide 中外制药株式会社 2022-06-17 — — CN disclosed
CN-113423877-A Mutant tRNAs for codon expansion 中外制药株式会社 2021-09-21 — — CN disclosed
CN-110869544-A Cyclic peptide compound having high membrane permeability and library containing same 中外制药株式会社 2020-03-06 — — CN disclosed
US-20200040372-A1 METHOD FOR SYNTHESIZING PEPTIDES IN CELL-FREE TRANSLATION SYSTEM CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2020-02-06 — — 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 (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-20230069218-A1 METHOD FOR PRODUCING PEPTIDE CONTAINING NON-NATURAL AMINO ACID MRPL21, RPL41, RPL21 ALDH1A1 4179/4885MEN1 2956/4885KMT2A 3285/4885
US-20200040372-A1 METHOD FOR SYNTHESIZING PEPTIDES IN CELL-FREE TRANSLATION SYSTEM AARS1, NSUN3, RNGTT ALDH1A1 4757/4885MEN1 2488/4885KMT2A 1543/4885
US-20230108274-A1 COMPOSITION FOR TRANSLATION, AND METHOD FOR PRODUCING PEPTIDE NSUN3, TARBP1, NOP2 ALDH1A1 4768/4885MEN1 3362/4885KMT2A 2391/4885

“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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