SCHEMBL3144977

SCHEMBL3144977

O=C(NC1CC1)c1ccc(-c2csc(NC(=O)C3CCCC3C(=O)NCc3ccccc3)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.51
▸ ROCK2 O75116 2/20 0.51
▸ ROCK1 Q13464 2/20 0.51
▸ SCD O00767 1/20 0.49
▸ HTT P42858 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ ELOVL1 Q9BW60 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ F2 P00734 1/20 0.48
▸ HDAC3 O15379 1/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC2 Q92769 1/20 0.45
▸ HDAC8 Q9BY41 1/20 0.45
▸ MAPT P10636 2/20 0.45
▸ USP2 O75604 1/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ MAPK1 P28482 1/20 0.45

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
SCHEMBL13524214 1.00 LMNA (0.51) LMNAROCK2ROCK1SCDHTT
SCHEMBL3134284 1.00 LMNA (0.51) LMNAROCK2ROCK1SCDHTT
SCHEMBL13713018 1.00 LMNA (0.51) LMNAROCK2ROCK1SCDHTT
SCHEMBL3144964 1.00 LMNA (0.51) LMNAROCK2ROCK1SCDHTT
SCHEMBL3134371 0.86 USP2 (0.56) LMNASCDHTTKDM4EALDH1A1
SCHEMBL3139817 0.86 USP2 (0.56) LMNASCDHTTKDM4EALDH1A1
SCHEMBL3134405 0.86 USP2 (0.56) LMNASCDHTTKDM4EALDH1A1
SCHEMBL3139831 0.86 USP2 (0.56) LMNASCDHTTKDM4EALDH1A1
SCHEMBL3134384 0.86 USP2 (0.56) LMNASCDHTTKDM4EALDH1A1
SCHEMBL3144838 0.83 KCNQ1 (0.53) LMNASCDALDH1A1SMN1; SMN2F2

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 7 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
US-7595398-B2 N-(5-membered aromatic ring)-amido anti-viral compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-09-29 — — US disclosed
US-7595398-B2 N-(5-membered aromatic ring)-amido anti-viral compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-09-29 — — US disclosed
US-20070265265-A1 N-(5-MEMBERED AROMATIC RING)-AMIDO ANTI-VIRAL COMPOUNDS GENELABS TECHNOLOGIES, INC. 2007-11-15 — — US disclosed
US-20070265265-A1 N-(5-MEMBERED AROMATIC RING)-AMIDO ANTI-VIRAL COMPOUNDS GENELABS TECHNOLOGIES, INC. 2007-11-15 — — US disclosed
US-20070265265-A1 N-(5-MEMBERED AROMATIC RING)-AMIDO ANTI-VIRAL COMPOUNDS GENELABS TECHNOLOGIES, INC. 2007-11-15 — — US 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 1094/4885ROCK2 4651/4885ROCK1 4586/4885
US-20070265265-A1 N-(5-MEMBERED AROMATIC RING)-AMIDO ANTI-VIRAL COMPOUNDS ZC3HAV1, ZC3HAV1L, HAVCR2 LMNA 1094/4885ROCK2 4651/4885ROCK1 4586/4885

“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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