SCHEMBL7181079

SCHEMBL7181079

CCCCCCCC1=C2C=CC(=N2)C=C2C=CC(=N2)C(CCCCCCC)=C2C=CC(=N2)C(c2cc(O)ccc2O)=C2C=CC1=N2

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ ALOX5 P09917 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ TYR P14679 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL7180826 0.99 MEN1 (0.34) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL586062 0.85 GCGR (0.34) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL585686 0.83 PTGS2 (0.35) CYP3A4
SCHEMBL17419217 0.81 ALOX5 (0.31) MEN1TP53ALOX5MAPTALOX15
SCHEMBL6003914 0.80 ALOX5 (0.31) MEN1TP53ALOX5MAPTALOX15
SCHEMBL7155236 0.79 GHSR (0.31) CYP3A4
SCHEMBL1772836 0.79 ALOX5 (0.30) MEN1TP53ALOX5MAPTALOX15
SCHEMBL7262706 0.76 TLR8 (0.32) MEN1MAPTKMT2A
SCHEMBL585042 0.76 TLR8 (0.36) —
SCHEMBL7717025 0.75 — —

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-6602998-B2 Connector for energy transfer devices; photosynthesis sytems; solar cells NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2003-08-05 — — US disclosed
US-20010027252-A1 Novel mercapto-substitued imidazolylporphyrin metal complex monomer, polymer having the same as a repeating unit and method of preparing the same NARA INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2001-10-04 — — 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-20010027252-A1 Novel mercapto-substitued imidazolylporphyrin metal complex monomer, polymer having the same as a repeating unit and method of preparing the same AP1M1, MGAT3, AP3M1 MEN1 1382/4885TP53 4076/4885CYP3A4 2412/4885

“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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