SCHEMBL17427334

SCHEMBL17427334

OCc1cc(CCc2ccc(N(c3ccc(CCc4cc(CO)c(O)c(CO)c4)cc3)c3ccc(-c4ccc(N(c5ccc(CCc6cc(CO)c(O)c(CO)c6)cc5)c5ccc(CCc6cc(CO)c(O)c(CO)c6)cc5)cc4)cc3)cc2)cc(CO)c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ CASP6 P55212 1/20 0.37
▸ LTA4H P09960 1/20 0.36
▸ SHBG P04278 1/20 0.36
▸ CALM1 P0DP23 2/20 0.35
▸ PTGS1 P23219 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ ESR1 P03372 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ MCL1 Q07820 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.32
▸ CYP17A1 P05093 1/20 0.32
▸ CYP21A2 P08686 1/20 0.32
▸ CYP11B1 P15538 1/20 0.32
▸ AKR1C2 P52895 1/20 0.31
▸ AKR1C1 Q04828 1/20 0.31
▸ GPR84 Q9NQS5 1/20 0.31

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
SCHEMBL19738378 0.75 FFAR1 (0.41) KDM4EALDH1A1HPGDHSD17B10SHBG
SCHEMBL14730143 0.74 FFAR1 (0.47) LTA4HPTGS1GPR84
SCHEMBL309287 0.73 MKNK1 (0.45) LTA4HPTGS1HRH3ERN1
SCHEMBL22941869 0.73 MKNK1 (0.45) LTA4HPTGS1HRH3ERN1
SCHEMBL13599813 0.73 MKNK1 (0.45) LTA4HPTGS1HRH3ERN1
SCHEMBL12679110 0.73 CA2 (0.45) KDM4EALDH1A1HRH3
SCHEMBL17577153 0.72 SHBG (0.42) KDM4EALDH1A1HPGDHSD17B10SHBG
SCHEMBL20762690 0.72 KIF11 (0.41) KDM4EALDH1A1HPGDHSD17B10CASP6
SCHEMBL17578343 0.71 TP53 (0.44) KDM4EALDH1A1HPGDHSD17B10SHBG
SCHEMBL13383868 0.71 MEN1 (0.46) ALDH1A1HSD17B10LTA4HHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9740117-B2 Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus, and condensed polycyclic aromatic compound CANON KABUSHIKI KAISHA (JP) 2017-08-22 — — US disclosed
US-9740117-B2 Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus, and condensed polycyclic aromatic compound CANON KABUSHIKI KAISHA (JP) 2017-08-22 — — US disclosed
US-20160011529-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, ELECTROPHOTOGRAPHIC APPARATUS, AND CONDENSED POLYCYCLIC AROMATIC COMPOUND CANON KABUSHIKI KAISHA (JP) 2016-01-14 — — US disclosed
US-20160011529-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, ELECTROPHOTOGRAPHIC APPARATUS, AND CONDENSED POLYCYCLIC AROMATIC COMPOUND CANON KABUSHIKI KAISHA (JP) 2016-01-14 — — 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-20160011529-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, ELECTROPHOTOGRAPHIC APPARATUS, AND CONDENSED POLYCYCLIC AROMATIC COMPOUND SLC18A1, TRPA1, PAH KDM4E 4175/4885ALDH1A1 571/4885HPGD 307/4885

“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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