SCHEMBL3219079

SCHEMBL3219079

O=C(Cc1ccc(-c2ccc3nc([C@@H]4CCCN4C(=O)OCc4ccccc4)[nH]c3c2)cc1)NC1CC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.47
PRCP P42785 2/20 0.45
GID4 Q8IVV7 1/20 0.43
HCRTR1 O43613 8/20 0.43
HCRTR2 O43614 8/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL3204730 1.00 USP30 (0.47) USP30PRCPGID4HCRTR1HCRTR2
SCHEMBL3219377 0.94 USP30 (0.46) USP30PRCPGID4HCRTR1HCRTR2
SCHEMBL3212715 0.94 USP30 (0.46) USP30PRCPGID4HCRTR1HCRTR2
SCHEMBL12332122 0.91 USP30 (0.55) USP30PRCPHCRTR1HCRTR2
SCHEMBL3200648 0.91 USP30 (0.48) USP30PRCPHCRTR1HCRTR2
SCHEMBL3200630 0.91 USP30 (0.48) USP30PRCPHCRTR1HCRTR2
SCHEMBL3216206 0.90 USP30 (0.56) USP30PRCPHCRTR1HCRTR2
SCHEMBL3225751 0.90 USP30 (0.56) USP30PRCPHCRTR1HCRTR2
SCHEMBL3215219 0.88 USP30 (0.45) USP30PRCPHCRTR1HCRTR2
SCHEMBL3215233 0.88 USP30 (0.45) USP30PRCPHCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100055071-A1 Anti-Viral Compounds SMITHKLINE BEECHAM CORPORATION 2010-03-04 US disclosed
US-20100055071-A1 Anti-Viral Compounds SMITHKLINE BEECHAM CORPORATION 2010-03-04 US disclosed
US-20100055071-A1 Anti-Viral Compounds SMITHKLINE BEECHAM CORPORATION 2010-03-04 US disclosed
EP-2097405-A2 ANTI-VIRAL COMPOUNDS Smithkline Beecham Corporation (US) 2009-09-09 EP disclosed
US-20080193411-A1 Anti-viral Compounds GENELABS TECHNOLOGIES, INC. 2008-08-14 US disclosed
US-20080193411-A1 Anti-viral Compounds GENELABS TECHNOLOGIES, INC. 2008-08-14 US disclosed
US-20080193411-A1 Anti-viral Compounds GENELABS TECHNOLOGIES, INC. 2008-08-14 US disclosed
WO-2008070447-A2 ANTI-VIRAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2008-06-12 WO disclosed
WO-2008070447-A2 ANTI-VIRAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2008-06-12 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 (2 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-20080193411-A1 Anti-viral Compounds ZC3HAV1, ZC3HAV1L, SARS1 USP30 4072/4885PRCP 983/4885GID4 2288/4885
US-20100055071-A1 Anti-Viral Compounds ZC3HAV1, ZC3HAV1L, SARS1 USP30 4072/4885PRCP 983/4885GID4 2288/4885

“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.