SCHEMBL28827581

SCHEMBL28827581

O=C(CCc1ccccc1)OC[C@H]1O[C@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK1 P06493 1/20 0.57
▸ CCNB1 P14635 1/20 0.57
▸ SYNJ2 O15056 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ ABL1 P00519 1/20 0.44
▸ ALPL P05186 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ ALPI P09923 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ ALPG P10696 1/20 0.44
▸ PABPC1 P11940 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ GALK1 P51570 1/20 0.44
▸ CASP7 P55210 1/20 0.44
▸ CASP6 P55212 1/20 0.44
▸ MCL1 Q07820 1/20 0.44
▸ RIN1 Q13671 1/20 0.44
▸ EIF4H Q15056 1/20 0.44
▸ LDHA P00338 1/20 0.44

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
SCHEMBL27529370 0.90 CDK1 (0.59) CDK1CCNB1SYNJ2KDM4EABL1
SCHEMBL3131927 0.88 CDK1 (0.69) CDK1CCNB1LDHAEPHX2CA2
SCHEMBL27699682 0.86 CDK1 (0.64) CDK1CCNB1SYNJ2LDHAEPHX2
SCHEMBL9621810 0.86 CDK1 (0.66) CDK1CCNB1LDHAEPHX2CA2
SCHEMBL8649826 0.86 CDK1 (0.66) CDK1CCNB1LDHAEPHX2CA2
SCHEMBL6358120 0.85 CDK1 (0.53) CDK1CCNB1SYNJ2KDM4EABL1
SCHEMBL6357706 0.85 CDK1 (0.53) CDK1CCNB1SYNJ2KDM4EABL1
SCHEMBL6358258 0.85 CDK1 (0.62) CDK1CCNB1SYNJ2LDHAEPHX2
SCHEMBL237200 0.84 CDK1 (0.61) CDK1CCNB1SYNJ2POLBGAA
SCHEMBL983823 0.84 CDK1 (0.64) CDK1CCNB1LDHAEPHX2CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114957352-B Sucrose phenylpropionate compound with cholinesterase inhibition activity, and preparation and application thereof 中山大学 2023-08-04 — — CN claimed
CN-114957352-A Sucrose phenylpropionate compound with cholinesterase inhibitory activity and preparation and application thereof 中山大学 2022-08-30 — — CN claimed
CN-114957352-B Sucrose phenylpropionate compound with cholinesterase inhibition activity, and preparation and application thereof 中山大学 2023-08-04 — — CN disclosed
CN-114957352-B Sucrose phenylpropionate compound with cholinesterase inhibition activity, and preparation and application thereof 中山大学 2023-08-04 — — CN disclosed
CN-114957352-B Sucrose phenylpropionate compound with cholinesterase inhibition activity, and preparation and application thereof 中山大学 2023-08-04 — — CN disclosed
CN-114957352-A Sucrose phenylpropionate compound with cholinesterase inhibitory activity and preparation and application thereof 中山大学 2022-08-30 — — CN disclosed
CN-114957352-A Sucrose phenylpropionate compound with cholinesterase inhibitory activity and preparation and application thereof 中山大学 2022-08-30 — — CN disclosed
CN-114957352-A Sucrose phenylpropionate compound with cholinesterase inhibitory activity and preparation and application thereof 中山大学 2022-08-30 — — CN disclosed
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