SCHEMBL29025164

SCHEMBL29025164

N#Cc1cc(=O)cc[nH]1

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
SCHEMBL61388 0.67 — —
SCHEMBL3708688 0.66 GPR84 (0.39) —
SCHEMBL1027196 0.65 — —
SCHEMBL27664732 0.65 — —
Hydrochloric Acid SCHEMBL5108516 0.65 — —
SCHEMBL2632908 0.64 — —
SCHEMBL89220 0.62 — —
SCHEMBL2406912 0.62 — —
SCHEMBL17495019 0.62 — —
Hydrochloric Acid SCHEMBL9285711 0.62 — —

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
CN-116365023-A Lithium ion battery electrolyte and lithium ion battery using same 宁德国泰华荣新材料有限公司 2023-06-30 — — CN disclosed
CN-116344911-A High nickel lithium battery 宁德国泰华荣新材料有限公司 2023-06-27 — — CN disclosed
Send feedback