SCHEMBL17653355

SCHEMBL17653355

O=c1[nH]c2ccc(NCc3cc(Cl)ccc3OCc3ccccc3F)cc2[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 9/20 0.68
▸ L3MBTL1 Q9Y468 4/20 0.68
▸ MAPT P10636 6/20 0.68
▸ MEN1 O00255 7/20 0.68
▸ KMT2A Q03164 7/20 0.68
▸ FNTA P49354 1/20 0.67
▸ FNTB P49356 1/20 0.67
▸ LMNA P02545 3/20 0.64
▸ SMN1; SMN2 Q16637 1/20 0.63
▸ NPSR1 Q6W5P4 1/20 0.63
▸ THRB P10828 1/20 0.59
▸ PKM P14618 1/20 0.55
▸ KDM4E B2RXH2 1/20 0.55

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
SCHEMBL17653389 0.81 GAA (1.00) GAAL3MBTL1MAPTMEN1KMT2A
SCHEMBL17653326 0.81 GAA (1.00) GAAL3MBTL1MAPTMEN1KMT2A
SCHEMBL17653306 0.78 GAA (0.82) GAAL3MBTL1MAPTMEN1KMT2A
SCHEMBL16995662 0.77 FNTA (0.65) GAAL3MBTL1MAPTMEN1KMT2A
SCHEMBL17653356 0.76 GAA (0.83) GAAL3MBTL1MAPTMEN1KMT2A
SCHEMBL17653354 0.75 GAA (0.50) GAAL3MBTL1MAPTMEN1KMT2A
SCHEMBL17653370 0.74 GAA (0.69) GAAL3MBTL1MAPTMEN1KMT2A
SCHEMBL14774677 0.70 MEN1 (0.64) GAAL3MBTL1MAPTMEN1KMT2A
SCHEMBL18669002 0.67 GAA (0.60) GAAL3MBTL1MAPTMEN1KMT2A
SCHEMBL22190920 0.66 GAA (0.64) GAAL3MBTL1MAPTMEN1KMT2A

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-10112895-B2 Antivirals against molluscum contagiosum virus THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2018-10-30 — — US claimed
US-20170217882-A1 ANTIVIRALS AGAINST MOLLUSCUM CONTAGIOSUM VIRUS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2017-08-03 — — US claimed
US-10112895-B2 Antivirals against molluscum contagiosum virus THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2018-10-30 — — US disclosed
EP-3200778-A1 ANTIVIRALS AGAINST MOLLUSCUM CONTAGIOSUM VIRUS The Trustees Of The University Of Pennsylvania (US) 2017-08-09 — — EP disclosed
US-20170217882-A1 ANTIVIRALS AGAINST MOLLUSCUM CONTAGIOSUM VIRUS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2017-08-03 — — US disclosed
US-20170217882-A1 ANTIVIRALS AGAINST MOLLUSCUM CONTAGIOSUM VIRUS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2017-08-03 — — US disclosed
US-20170217882-A1 ANTIVIRALS AGAINST MOLLUSCUM CONTAGIOSUM VIRUS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2017-08-03 — — US disclosed
WO-2016053893-A1 ANTIVIRALS AGAINST MOLLUSCUM CONTAGIOSUM VIRUS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-04-07 — — WO disclosed
WO-2016053893-A1 ANTIVIRALS AGAINST MOLLUSCUM CONTAGIOSUM VIRUS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-04-07 — — 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-10112895-B2 Antivirals against molluscum contagiosum virus EIF2AK2, IRF3, ZC3HAV1 GAA 67/4885L3MBTL1 2533/4885MAPT 1601/4885
US-20170217882-A1 ANTIVIRALS AGAINST MOLLUSCUM CONTAGIOSUM VIRUS EIF2AK2, IRF3, ZC3HAV1 GAA 67/4885L3MBTL1 2533/4885MAPT 1601/4885

“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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