SCHEMBL28647014

SCHEMBL28647014

O[C@@H]1[C@H](O)CN[C@@H]1CCNc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAN1B1 Q9UKM7 10/20 1.00
GBA1 P04062 8/20 0.51
MAN2A1 Q16706 8/20 0.49
MAN2B1 O00754 1/20 0.48
GLB1 P16278 1/20 0.47
GBA2 Q9HCG7 1/20 0.47

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
SCHEMBL21578194 0.71 MAN1B1 (0.64) MAN1B1GBA1MAN2A1MAN2B1GLB1
SCHEMBL21578193 0.71 MAN1B1 (0.64) MAN1B1GBA1MAN2A1MAN2B1GLB1
SCHEMBL21578196 0.71 MAN1B1 (0.64) MAN1B1GBA1MAN2A1MAN2B1GLB1
SCHEMBL20470481 0.71 MAN1B1 (0.64) MAN1B1GBA1MAN2A1MAN2B1GLB1
SCHEMBL2433156 0.67 MAN1B1 (0.57) MAN1B1MAN2A1MAN2B1
SCHEMBL17064950 0.66 ALDH1A1 (0.54) MAN1B1
SCHEMBL14987751 0.66 GBA1 (1.00) MAN1B1GBA1GLB1GBA2
SCHEMBL28647018 0.66 GLB1 (0.73) MAN1B1GBA1MAN2B1GLB1GBA2
SCHEMBL13808578 0.65 MAN1B1 (1.00) MAN1B1MAN2A1MAN2B1
SCHEMBL28652164 0.65 MAN1B1 (0.48) MAN1B1GBA1GLB1

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-113493628-A Quantum dot ink and preparation method of quantum dot film TCL科技集团股份有限公司 2021-10-12 CN claimed
CN-113122053-A Quantum dot ink and preparation method of quantum dot film TCL集团股份有限公司 2021-07-16 CN claimed
CN-113493628-B Quantum dot ink and preparation method of quantum dot film TCL科技集团股份有限公司 2023-06-23 CN disclosed
CN-113493628-A Quantum dot ink and preparation method of quantum dot film TCL科技集团股份有限公司 2021-10-12 CN disclosed
CN-113122053-A Quantum dot ink and preparation method of quantum dot film TCL集团股份有限公司 2021-07-16 CN disclosed