SCHEMBL10017406

SCHEMBL10017406

C1=C/C2=C(\c3ccncc3)c3ccc([nH]3)/C(c3ccncc3)=C3/C=CC(N3)/C(c3ccncc3)=c3/cc/c([nH]3)=C(\c3ccncc3)C1=N2

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL14076169 0.89 — —
SCHEMBL859361 0.88 GCGR (0.33) —
SCHEMBL7705568 0.81 TOP1 (0.34) —
SCHEMBL3459766 0.81 GCGR (0.32) —
SCHEMBL17366427 0.81 — —
SCHEMBL12331453 0.80 ALDH1A1 (0.32) —
SCHEMBL6036896 0.73 — —
SCHEMBL17366426 0.72 GCGR (0.41) —
SCHEMBL5384591 0.72 CYP3A4 (0.34) —
SCHEMBL14257630 0.72 — —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1818123-B1 Process for producing stabilized gold nanoparticles, stabilized gold nanoparticles obtained by the process, and use of the stabilized gold nanoparticles JAPAN SCIENCE & TECH AGENCY (JP) 2012-01-11 — — EP disclosed
EP-1818123-A1 STABILIZED INORGANIC NANOPARTICLE, STABILIZED INORGANIC NANOPARTICLES, PROCESS FOR PRODUCING STABILIZED INORGANIC NANOPARTICLE, AND METHOD OF UTILIZING STABILIZED INORGANIC NANOPARTICLE Japan Science and Technology Agency (JP) 2007-08-15 — — EP disclosed
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