SCHEMBL23917915

SCHEMBL23917915

Nc1ccc(OC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Oc4ccc(N5C(=O)c6ccc(C(=O)Oc7ccc(N)nc7)cc6C5=O)cc4)cc2)C3=O)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.50
▸ PTGES O14684 1/20 0.50
▸ CA1 P00915 2/20 0.47
▸ CA2 P00918 2/20 0.47
▸ CA4 P22748 2/20 0.47
▸ CA9 Q16790 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ MET P08581 1/20 0.45
▸ BRD4 O60885 1/20 0.44
▸ FNTA P49354 1/20 0.43
▸ FNTB P49356 1/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ LPAR1 Q92633 1/20 0.43
▸ LPAR5 Q9H1C0 1/20 0.43
▸ LPAR3 Q9UBY5 1/20 0.43
▸ PKM P14618 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ F2 P00734 1/20 0.41
▸ PRSS1 P07477 1/20 0.41

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
SCHEMBL23917916 0.90 ALDH1A1 (0.47) ALDH1A1PTGESCA1CA2CA4
SCHEMBL23917921 0.90 POLB (0.49) ALDH1A1PTGESCA1CA2CA4
SCHEMBL23917922 0.87 ALDH1A1 (0.44) ALDH1A1PTGESCA1CA2CA4
SCHEMBL23917918 0.86 ALDH1A1 (0.50) ALDH1A1PTGESCA1CA2CA4
SCHEMBL23917902 0.86 ALDH1A1 (0.54) ALDH1A1PTGESCA1CA2CA4
SCHEMBL23917923 0.85 ALDH1A1 (0.43) ALDH1A1PTGESCA1CA2CA4
SCHEMBL23917903 0.84 PTGES (0.48) ALDH1A1PTGESCA1CA2CA4
SCHEMBL24236734 0.83 MEN1 (0.59) ALDH1A1CA1CA2CA4CA9
SCHEMBL12923693 0.81 FNTA (0.57) ALDH1A1PTGESCA1CA2CA4
SCHEMBL13320288 0.78 FNTA (0.54) ALDH1A1PTGESCA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210317082-A1 DIAMINE COMPOUND, POLYIMIDE PRECURSOR USING SAME, AND POLYIMIDE FILM LG CHEM, LTD. (KR) 2021-10-14 — — 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 (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-20210317082-A1 DIAMINE COMPOUND, POLYIMIDE PRECURSOR USING SAME, AND POLYIMIDE FILM DDC, ODC1, PUF60 ALDH1A1 2250/4885PTGES 3535/4885CA1 823/4885

“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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