SCHEMBL29010741

SCHEMBL29010741

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

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.59
METTL3 Q86U44 1/20 0.59
CTSK P43235 1/20 0.57
HSP90AA1 P07900 1/20 0.56
CTSL P07711 1/20 0.54

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
SCHEMBL13826734 1.00 ATM (0.59) ATMMETTL3CTSKHSP90AA1CTSL
SCHEMBL15501263 0.95 ATM (0.54) ATMMETTL3CTSKHSP90AA1CTSL
SCHEMBL31192684 0.92 ATM (0.51) ATMMETTL3CTSKHSP90AA1CTSL
SCHEMBL5527650 0.92 ATM (0.51) ATMMETTL3CTSKHSP90AA1CTSL
SCHEMBL5527648 0.92 ATM (0.51) ATMMETTL3CTSKHSP90AA1CTSL
SCHEMBL6743847 0.82 HSP90AA1 (0.49) ATMMETTL3CTSKHSP90AA1
SCHEMBL13826733 0.82 LMNA (0.59) HSP90AA1
SCHEMBL6743841 0.82 HSP90AA1 (0.49) ATMMETTL3CTSKHSP90AA1
SCHEMBL941093 0.81 TOP2A (0.70) ATMMETTL3CTSKHSP90AA1
SCHEMBL941092 0.81 TOP2A (0.70) ATMMETTL3CTSKHSP90AA1

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
CN-116196468-A Dithiosemicarbazide modified injectable folic acid coupled polydopamine hydrogel and application thereof in antibacterial aspect 河南大学 2023-06-02 CN claimed
CN-116196468-B Dithiosemicarbazide modified injectable folic acid coupled polydopamine hydrogel and application thereof in antibacterial aspect 河南大学 2024-11-08 CN disclosed
CN-116196468-B Dithiosemicarbazide modified injectable folic acid coupled polydopamine hydrogel and application thereof in antibacterial aspect 河南大学 2024-11-08 CN disclosed
CN-116196468-A Dithiosemicarbazide modified injectable folic acid coupled polydopamine hydrogel and application thereof in antibacterial aspect 河南大学 2023-06-02 CN disclosed
CN-116196468-A Dithiosemicarbazide modified injectable folic acid coupled polydopamine hydrogel and application thereof in antibacterial aspect 河南大学 2023-06-02 CN disclosed