SCHEMBL28599017

SCHEMBL28599017

C=Cn1cc[n+](C)c1CC.COS(=O)(=O)[O-]

nearest known ligand 0.32

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HTT P42858 1/20 0.30

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
SCHEMBL28604119 0.89 HTT (0.31) LMNANPSR1HTT
SCHEMBL13822603 0.84 HDAC8 (0.30)
SCHEMBL538961 0.81 NPSR1 (0.33) NPSR1
SCHEMBL28722829 0.79 APOBEC3A (0.42) LMNANPSR1HTT
SCHEMBL28598099 0.79 HTT (0.30) HTT
SCHEMBL28599015 0.74 LMNA (0.32) LMNAHTT
SCHEMBL28724264 0.73
Sulfuric Acid SCHEMBL8849669 0.70
SCHEMBL26629646 0.70 HTT (0.32) HTT
SCHEMBL11272078 0.69 HDAC8 (0.35) LMNANPSR1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113130992-B Non-aqueous electrolyte and lithium ion battery 诺莱特电池材料(苏州)有限公司 2022-09-23 CN claimed
CN-113130992-A Non-aqueous electrolyte and lithium ion battery 诺莱特电池材料(苏州)有限公司 2021-07-16 CN claimed
CN-113130992-B Non-aqueous electrolyte and lithium ion battery 诺莱特电池材料(苏州)有限公司 2022-09-23 CN disclosed
CN-113130992-A Non-aqueous electrolyte and lithium ion battery 诺莱特电池材料(苏州)有限公司 2021-07-16 CN disclosed