SCHEMBL5527650

SCHEMBL5527650

CC(=O)c1cccc(C(C)=NNC(N)=S)n1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.51
METTL3 Q86U44 1/20 0.51
CTSK P43235 1/20 0.51
HSP90AA1 P07900 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CTSL P07711 1/20 0.48

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
SCHEMBL5527648 1.00 ATM (0.51) ATMMETTL3CTSKHSP90AA1ALDH1A1
SCHEMBL31192684 1.00 ATM (0.51) ATMMETTL3CTSKHSP90AA1ALDH1A1
SCHEMBL13826734 0.92 ATM (0.59) ATMMETTL3CTSKHSP90AA1CTSL
SCHEMBL29010741 0.92 ATM (0.59) ATMMETTL3CTSKHSP90AA1CTSL
SCHEMBL15501263 0.88 ATM (0.54) ATMMETTL3CTSKHSP90AA1CTSL
SCHEMBL29010740 0.84 TOP2A (0.61) HSP90AA1ALDH1A1
SCHEMBL13826733 0.82 LMNA (0.59) HSP90AA1ALDH1A1
SCHEMBL15501375 0.78 LMNA (0.54) HSP90AA1ALDH1A1
SCHEMBL6743847 0.76 HSP90AA1 (0.49) ATMMETTL3CTSKHSP90AA1ALDH1A1
SCHEMBL6743841 0.76 HSP90AA1 (0.49) ATMMETTL3CTSKHSP90AA1ALDH1A1

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
CN-109651414-B Indium compound with 2, 6-diacetyl pyridine thiosemicarbazone as ligand and synthetic method and application thereof 广西师范大学 2020-12-22 CN claimed
CN-109651414-A It is a kind of using 2,6-diacetylpyridine thiosemicarbazones as the indium compound of ligand and its synthetic method and application 广西师范大学 2019-04-19 CN claimed
CN-109651414-B Indium compound with 2, 6-diacetyl pyridine thiosemicarbazone as ligand and synthetic method and application thereof 广西师范大学 2020-12-22 CN disclosed
CN-109651414-B Indium compound with 2, 6-diacetyl pyridine thiosemicarbazone as ligand and synthetic method and application thereof 广西师范大学 2020-12-22 CN disclosed
CN-109651414-B Indium compound with 2, 6-diacetyl pyridine thiosemicarbazone as ligand and synthetic method and application thereof 广西师范大学 2020-12-22 CN disclosed
CN-109651414-A It is a kind of using 2,6-diacetylpyridine thiosemicarbazones as the indium compound of ligand and its synthetic method and application 广西师范大学 2019-04-19 CN disclosed
CN-109651414-A It is a kind of using 2,6-diacetylpyridine thiosemicarbazones as the indium compound of ligand and its synthetic method and application 广西师范大学 2019-04-19 CN disclosed
CN-109651414-A It is a kind of using 2,6-diacetylpyridine thiosemicarbazones as the indium compound of ligand and its synthetic method and application 广西师范大学 2019-04-19 CN disclosed
US-20070197495-A1 ANTI-PARASITIC COMPOUNDS AND METHODS OF THEIR USE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-08-23 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 (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-20070197495-A1 ANTI-PARASITIC COMPOUNDS AND METHODS OF THEIR USE CYP51A1, TUBA3C, PIGO ATM 4843/4885METTL3 4301/4885CTSK 107/4885

“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.