SCHEMBL28496394

SCHEMBL28496394

CCOP(=O)(OCC)Oc1cccc(C#N)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
CA2 P00918 2/20 0.43
CA1 P00915 1/20 0.43
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
GLA P06280 1/20 0.42
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
KCNN4 O15554 1/20 0.39
KCNA5 P22460 1/20 0.39
GSK3B P49841 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39

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
SCHEMBL7772917 0.84 MEN1 (0.54) MEN1POLBGAAKMT2ACA2
SCHEMBL10837632 0.82 ALDH1A1 (0.42) POLBCA1GLAPDCD1CD274
SCHEMBL28468494 0.81 KCNA5 (0.46) GLAKCNN4KCNA5
SCHEMBL17512952 0.81 CA1 (0.55) MEN1POLBGAAKMT2ACA2
SCHEMBL20582501 0.79 MEN1 (0.41) MEN1POLBGAAKMT2ACA2
SCHEMBL4244557 0.78 GLA (0.51) GLARXFP1
SCHEMBL8994730 0.78 HCRTR1 (0.50) MEN1POLBGAAKMT2ACA2
SCHEMBL1727475 0.78 GAA (0.53) MEN1POLBGAAKMT2ACA2
SCHEMBL13731074 0.77 KMT2A (0.56) MEN1POLBGAAKMT2A
SCHEMBL22619019 0.76 MEN1 (0.47) MEN1POLBGAAKMT2ACA2

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-115073519-A High-low temperature resistant flame retardant for polyester, preparation method and application thereof 寿光卫东化工有限公司 2022-09-20 CN claimed
CN-112186251-A Non-aqueous electrolyte of lithium ion battery and lithium ion battery 香河昆仑化学制品有限公司 2021-01-05 CN claimed
CN-119481277-A Lithium ion battery electrolyte and application thereof 远景睿泰动力技术(上海)有限公司 2025-02-18 CN disclosed
CN-115073519-A High-low temperature resistant flame retardant for polyester, preparation method and application thereof 寿光卫东化工有限公司 2022-09-20 CN disclosed
CN-112186251-A Non-aqueous electrolyte of lithium ion battery and lithium ion battery 香河昆仑化学制品有限公司 2021-01-05 CN disclosed