SCHEMBL3141162

SCHEMBL3141162

O=C(CBr)c1ccc(S(=O)(=O)NC2CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.57
▸ KMT2A Q03164 5/20 0.56
▸ MEN1 O00255 4/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ RECQL P46063 1/20 0.54
▸ ALDH1A1 P00352 6/20 0.51
▸ MAPK1 P28482 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ GAA P10253 1/20 0.49
▸ POLB P06746 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ TSHR P16473 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
SCHEMBL3134886 0.94 MEN1 (0.65) LMNAKMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL12970708 0.92 ALDH1A1 (0.65) LMNAKMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL12970709 0.92 ALDH1A1 (0.65) LMNAKMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL3721741 0.80 LMNA (0.63) LMNAKMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL11673735 0.79 GSK3B (0.42) LMNA
SCHEMBL5466144 0.79 LMNA (0.61) LMNAKMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL12572048 0.78 KMT2A (0.72) LMNAKMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL5649036 0.77 GSK3B (0.53) LMNASMN1; SMN2ALDH1A1MAPK1HTT
SCHEMBL14844102 0.77 SMN1; SMN2 (0.61) LMNAKMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL3387592 0.76 ALDH1A1 (0.70) LMNAKMT2AMEN1SMN1; SMN2KDM4E

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-20100004441-A1 N-(5-Membered Aromatic Ring)-Amido Anti-Viral Compounds SCHMITZ FRANZ ULRICH 2010-01-07 — — US disclosed
US-7595398-B2 N-(5-membered aromatic ring)-amido anti-viral compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-09-29 — — US disclosed
EP-1971597-A2 N-(5-MEMBERED HETEROAROMATIC RING)-AMIDO ANTI-VIRAL COMPOUNDS GENELABS TECHNOLOGIES, INC. (US) 2008-09-24 — — EP disclosed
US-20070265265-A1 N-(5-MEMBERED AROMATIC RING)-AMIDO ANTI-VIRAL COMPOUNDS GENELABS TECHNOLOGIES, INC. 2007-11-15 — — US disclosed
WO-2007070600-A2 N-(5-MEMBERED HETEROAROMATIC RING)-AMIDO ANTI-VIRAL COMPOUNDS GENELABS TECHNOLOGIES, INC. (US) 2007-06-21 — — 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-20100004441-A1 N-(5-Membered Aromatic Ring)-Amido Anti-Viral Compounds ZC3HAV1, ZC3HAV1L, HAVCR2 LMNA 1094/4885KMT2A 2419/4885MEN1 3838/4885
US-20070265265-A1 N-(5-MEMBERED AROMATIC RING)-AMIDO ANTI-VIRAL COMPOUNDS ZC3HAV1, ZC3HAV1L, HAVCR2 LMNA 1094/4885KMT2A 2419/4885MEN1 3838/4885

“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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