SCHEMBL13911060

SCHEMBL13911060

c1ccc(Oc2ccc(-[n+]3ccc(-c4cc[n+](-c5cccc(Oc6ccccc6)c5)cc4)cc3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.42
▸ LTA4H P09960 3/20 0.40
▸ TSHR P16473 1/20 0.40
▸ GSTP1 P09211 1/20 0.40
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ MITF O75030 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ NLRP1 Q9C000 1/20 0.39
▸ NOD2 Q9HC29 1/20 0.39
▸ AKR1C3 P42330 1/20 0.39
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ FFAR1 O14842 1/20 0.38
▸ FFAR4 Q5NUL3 1/20 0.38
▸ MAOA P21397 2/20 0.37

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
SCHEMBL12240001 1.00 MAOB (0.42) MAOBLTA4HTSHRGSTP1MEN1
SCHEMBL12240441 0.95 MEN1 (0.44) MAOBLTA4HTSHRGSTP1MEN1
SCHEMBL12240440 0.93 MAOB (0.40) MAOBLTA4HTSHRGSTP1MEN1
SCHEMBL12239729 0.93 MEN1 (0.46) MAOBLTA4HTSHRGSTP1MEN1
SCHEMBL13911039 0.91 LTA4H (0.48) LTA4HTSHRGSTP1MEN1KMT2A
SCHEMBL12240006 0.90 FFAR1 (0.38) MAOBLTA4HTSHRGSTP1CA1
SCHEMBL12240005 0.90 SRD5A2 (0.41) MAOBLTA4HTSHRALDH1A1SMN1; SMN2
SCHEMBL13943794 0.89 LTA4H (0.50) LTA4HTSHRGSTP1MEN1KMT2A
SCHEMBL12240445 0.89 LTA4H (0.44) LTA4HTSHRGSTP1CA1CA2
SCHEMBL12239725 0.89 LTA4H (0.50) LTA4HTSHRGSTP1MEN1KMT2A

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-20090082570-A1 METHOD OF MANUFACTURING BIPYRIDINIUM COMPOUND AND SYNTHETIC INTERMEDIATE OF THE SAME, METHOD OF MANUFACTURING DYE COMPOUND, AND NOVEL BIPYRIDINIUM COMPOUND AND NOVEL DYE COMPOUND COMPRISING THE SAME FUJIFILM CORPORATION (JP) 2009-03-26 — — 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-20090082570-A1 METHOD OF MANUFACTURING BIPYRIDINIUM COMPOUND AND SYNTHETIC INTERMEDIATE OF THE SAME, METHOD OF MANUFACTURING DYE COMPOUND, AND NOVEL BIPYRIDINIUM COMPOUND AND NOVEL DYE COMPOUND COMPRISING THE SAME RRS1, RPS3, ADRM1 MAOB 1098/4885LTA4H 3503/4885TSHR 398/4885

“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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