SCHEMBL1455298

SCHEMBL1455298

O=C(O)c1cc([N+](=O)[O-])c(Sc2ccc(O)cc2)s1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ USP47 Q96K76 10/20 0.65
▸ USP7 Q93009 13/20 0.62
▸ PADI4 Q9UM07 1/20 0.62
▸ USP10 Q14694 1/20 0.46
▸ DTYMK P23919 1/20 0.43
▸ P2RY14 Q15391 1/20 0.42
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ CASP6 P55212 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
SCHEMBL4976935 0.89 USP47 (0.62) USP47USP7PADI4USP10DTYMK
SCHEMBL27889362 0.81 USP47 (0.57) USP47USP7PADI4USP10P2RY14
SCHEMBL1454993 0.81 USP7 (0.57) USP47USP7PADI4USP10CA1
SCHEMBL4975551 0.79 USP7 (0.51) USP47USP7PADI4USP10DTYMK
SCHEMBL2680315 0.78 USP7 (0.79) USP47USP7PADI4USP10MAPT
SCHEMBL4975019 0.78 P2RY14 (0.45) USP47USP7PADI4P2RY14CA1
SCHEMBL2681880 0.78 USP47 (0.85) USP47USP7PADI4USP10MAPT
SCHEMBL2681089 0.77 USP7 (0.77) USP47USP7PADI4USP10MAPT
SCHEMBL2681219 0.77 USP7 (0.79) USP47USP7PADI4
SCHEMBL2681075 0.77 USP7 (1.00) USP47USP7PADI4USP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1979348-B1 ANTI-VIRAL COMPOUNDS ABBOTT LAB (US) 2012-01-18 — — EP disclosed
US-7910595-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2011-03-22 — — US disclosed
CN-101384591-A Antiviral compounds ABBOTT LAB (US) 2009-03-11 — — CN disclosed
EP-1979348-A2 ANTI-VIRAL COMPOUNDS Abbott Laboratories (US) 2008-10-15 — — EP disclosed
US-20070232627-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-10-04 — — US disclosed
WO-2007076034-A2 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2007-07-05 — — WO 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-20070232627-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 USP47 1620/4885USP7 1912/4885PADI4 3547/4885

“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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