SCHEMBL28464253

SCHEMBL28464253

O=C(Cl)CCN1C(=O)OC[C@@H]1c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.46
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HDAC1 Q13547 2/20 0.44
GLS O94925 4/20 0.44
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
SCD5 Q86SK9 1/20 0.39
IDH1 O75874 4/20 0.38
AVPR1A P37288 1/20 0.38

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
SCHEMBL9036084 0.87 GLS (0.49) NPC1LMNATP53HPGDRAB9A
SCHEMBL42681 0.87 GLS (0.49) NPC1LMNATP53HPGDRAB9A
SCHEMBL42111 0.87 GLS (0.49) NPC1LMNATP53HPGDRAB9A
SCHEMBL42224 0.81 GLS (0.51) NPC1LMNATP53HPGDRAB9A
SCHEMBL1285658 0.81 GLS (0.51) NPC1LMNATP53HPGDRAB9A
SCHEMBL43071 0.81 GLS (0.51) NPC1LMNATP53HPGDRAB9A
SCHEMBL2065162 0.80 GLS (0.42) NPC1LMNATP53HPGDRAB9A
SCHEMBL14665075 0.80 GLS (0.44) NPC1LMNATP53HPGDRAB9A
SCHEMBL2064442 0.80 GLS (0.42) NPC1LMNATP53HPGDRAB9A
SCHEMBL14665079 0.80 GLS (0.44) NPC1LMNATP53HPGDRAB9A

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-111295373-B Compositions and methods for treating brain injury 阿泽凡药物公司 2024-12-10 CN disclosed
CN-116327950-A Use of a composition for the treatment of neuropsychiatric symptoms of neurodegenerative diseases 阿泽范药品公司 2023-06-27 CN disclosed
CN-116139282-A Compositions and methods for treating neurodegenerative diseases 阿泽范药品公司 2023-05-23 CN disclosed
CN-106459021-B Compositions and methods for treating neurodegenerative diseases 阿泽范药品公司 2023-04-07 CN disclosed
CN-111295373-A Compositions and methods for treating brain injury 阿泽凡药物公司 2020-06-16 CN disclosed