SCHEMBL28348602

SCHEMBL28348602

COC(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.60
LMNA P02545 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
KDM4E B2RXH2 2/20 0.44
PDE4A P27815 1/20 0.39
USP2 O75604 1/20 0.37
SLCO1B1 Q9Y6L6 1/20 0.37
MGAM O43451 5/20 0.33
TOP1 P11387 1/20 0.32
SI P14410 1/20 0.32

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
SCHEMBL20390944 0.97 LMNA (0.58) TDP1LMNAL3MBTL1KDM4EPDE4A
Mannitol SCHEMBL27491847 0.81 LMNA (0.73) TDP1LMNAL3MBTL1KDM4EPDE4A
SCHEMBL14231360 0.80 LMNA (0.35) TDP1LMNAL3MBTL1KDM4E
SCHEMBL18133213 0.80 LMNA (0.35) TDP1LMNAL3MBTL1KDM4E
SCHEMBL10076813 0.80 LMNA (0.35) TDP1LMNAL3MBTL1KDM4E
SCHEMBL18133216 0.80 LMNA (0.35) TDP1LMNAL3MBTL1KDM4E
SCHEMBL18133215 0.80 LMNA (0.35) TDP1LMNAL3MBTL1KDM4E
SCHEMBL14646316 0.80 LMNA (0.35) TDP1LMNAL3MBTL1KDM4E
SCHEMBL18133218 0.80 LMNA (0.35) TDP1LMNAL3MBTL1KDM4E
SCHEMBL619758 0.79 TDP1 (0.67) TDP1LMNAL3MBTL1KDM4EPDE4A

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-115400055-A Multifunctional mouthwash and preparation method thereof 北京化工大学 2022-11-29 CN disclosed
CN-112791030-A Mouthwash and preparation method thereof 青岛广恩技术研发有限公司 2021-05-14 CN disclosed
CN-111000783-A Whitening, relieving and anti-aging essence and preparation method thereof 彭氏(惠州)实业发展有限公司 2020-04-14 CN disclosed
CN-106361642-B Pudilan mouthwash and preparation process thereof 济川药业集团有限公司 2019-12-10 CN disclosed