SCHEMBL1903016

SCHEMBL1903016

CC1(C)OB(c2ccc3cc4c(cc3c2)C(=O)c2cc3ccc(B5OC(C)(C)C(C)(C)O5)cc3cc2C4=O)OC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 13/20 0.50
▸ LIPG Q9Y5X9 13/20 0.50
▸ CA1 P00915 3/20 0.46
▸ CA2 P00918 3/20 0.46
▸ CA9 Q16790 3/20 0.46
▸ CA12 O43570 1/20 0.43
▸ CA3 P07451 1/20 0.43
▸ CA4 P22748 1/20 0.43
▸ CA6 P23280 1/20 0.43
▸ CA5A P35218 1/20 0.43
▸ CA7 P43166 1/20 0.43
▸ CA14 Q9ULX7 1/20 0.43
▸ CA5B Q9Y2D0 1/20 0.43
▸ IDO1 P14902 1/20 0.41
▸ TDO2 P48775 1/20 0.41
▸ IRAK4 Q9NWZ3 1/20 0.39
▸ CSF1R P07333 1/20 0.37
▸ PRMT5 O14744 1/20 0.37
▸ WDR77 Q9BQA1 1/20 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
SCHEMBL4299809 0.86 LPL (0.59) LPLLIPGCA1CA2CA9
SCHEMBL2708689 0.86 LPL (0.59) LPLLIPGCA1CA2CA9
SCHEMBL29644319 0.86 LPL (0.62) LPLLIPGCA1CA2CA9
SCHEMBL1293460 0.86 LPL (0.62) LPLLIPGCA1CA2CA9
SCHEMBL204700 0.84 CA1 (0.46) LPLLIPGCA1CA2CA9
SCHEMBL29387132 0.84 LPL (0.61) LPLLIPGCA1CA2CA9
SCHEMBL1294059 0.84 LPL (0.61) LPLLIPGCA1CA2CA9
SCHEMBL13142480 0.81 LPL (0.68) LPLLIPGCA1CA2CA9
SCHEMBL18719776 0.80 LPL (0.50) LPLLIPGCA1CA2CA9
SCHEMBL120527 0.79 LPL (0.75) LPLLIPGCA1CA2CA9

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-7935836-B2 Compounds comprising a linear series of five fused carbon rings, and preparation thereof FALLIS ALEXANDER GRAHAM 2011-05-03 — — US disclosed
US-20100004467-A1 COMPOUNDS COMPRISING A LINEAR SERIES OF FIVE FUSED CARBON RINGS, AND PREPARATION THEREOF FALLIS ALEXANDER GRAHAM 2010-01-07 — — 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-20100004467-A1 COMPOUNDS COMPRISING A LINEAR SERIES OF FIVE FUSED CARBON RINGS, AND PREPARATION THEREOF JUP, CDH1, EML4 LPL 4702/4885LIPG 4183/4885CA1 1324/4885

“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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