SCHEMBL3187466

SCHEMBL3187466

CS(=O)(=O)Nc1ccc(C(=O)O)nc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ P4HTM Q9NXG6 14/20 0.58
▸ KDM4E B2RXH2 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ P4HA1 P13674 1/20 0.47
▸ MIF P14174 1/20 0.47
▸ MMP2 P08253 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ GRIN2B Q13224 1/20 0.46
▸ KEAP1 Q14145 1/20 0.46

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
SCHEMBL16600991 0.86 ALDH1A1 (0.46) P4HTMKDM4EALDH1A1GRIN2BKEAP1
SCHEMBL25734158 0.83 P4HTM (0.50) P4HTMKDM4EMAPK1L3MBTL1ALDH1A1
SCHEMBL16600880 0.81 GRIN2B (0.47) P4HTMKDM4EALDH1A1GRIN2BKEAP1
SCHEMBL1201332 0.79 IGFBP3 (0.47) P4HTMMMP2ALDH1A1
SCHEMBL13548255 0.77 HPGD (0.46) KDM4EALDH1A1KEAP1
SCHEMBL8869353 0.76 P4HTM (0.57) P4HTMMAPK1ALDH1A1
SCHEMBL23384342 0.76 GRIN2B (0.38) P4HTMGRIN2BKEAP1
SCHEMBL3621496 0.76 P4HTM (0.59) P4HTMKDM4EMAPK1L3MBTL1P4HA1
SCHEMBL21485440 0.75 GRIN2B (0.48) P4HTMALDH1A1GRIN2B
SCHEMBL3621493 0.75 P4HTM (0.63) P4HTMKDM4EMAPK1L3MBTL1P4HA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8383824-B2 Heterocyclic antiviral compounds ROCHE PALO ALTO LLC (US) 2013-02-26 — — US claimed
CN-102639504-A Heterocyclic antiviral compounds HOFFMANN LA ROCHE 2012-08-15 — — CN claimed
CN-102099335-A Heterocyclic antiviral compounds HOFFMANN LA ROCHE 2011-06-15 — — CN claimed
WO-2010010017-A1 HETEROCYCLIC ANTIVIRAL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2010-01-28 — — WO claimed
US-20100021423-A1 Heterocyclic antiviral compounds ROCHE PALO ALTO LLC 2010-01-28 — — US claimed

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-20100021423-A1 Heterocyclic antiviral compounds POLR2A, RRM2B, RRP1B P4HTM 1917/4885KDM4E 1962/4885MAPK1 3018/4885

“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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