SCHEMBL28448343

SCHEMBL28448343

O=C(c1ccccc1)[C@]1(O)[C@H](O)[C@H](O)O[C@@H](CO)[C@@H]1O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HK1 P19367 2/20 0.41
HK2 P52789 2/20 0.41
LGALS9 O00182 2/20 0.39
LGALS1 P09382 2/20 0.39
LGALS3 P17931 2/20 0.39
LGALS7; LGALS7B P47929 2/20 0.39
EPHX1 P07099 1/20 0.36
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL28448346 1.00 HK1 (0.41) HK1HK2LGALS9LGALS1LGALS3
SCHEMBL8369357 0.83 LGALS3 (0.47) HK1HK2LGALS9LGALS1LGALS3
SCHEMBL9443607 0.82 LGALS8 (0.44) LGALS9LGALS1LGALS3LGALS7; LGALS7BALDH1A1
SCHEMBL22490904 0.78 LGALS9 (0.44) HK1HK2LGALS9LGALS1LGALS3
SCHEMBL8369358 0.76 LGALS9 (0.43) HK1HK2LGALS9LGALS1LGALS3
SCHEMBL9767764 0.76 CES1 (0.46) EPHX1ALDH1A1KDM4ELMNAPOLB
SCHEMBL9767756 0.76 CES1 (0.46) EPHX1ALDH1A1KDM4ELMNAPOLB
SCHEMBL9767838 0.76 CES1 (0.46) EPHX1ALDH1A1KDM4ELMNAPOLB
SCHEMBL28135293 0.75 PRKCA (0.32) HK1HK2EPHX1ALDH1A1
SCHEMBL28135295 0.75 PRKCA (0.32) HK1HK2EPHX1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111575096-B Antirust gearbox engine oil and preparation method thereof 山东零公里润滑科技有限公司 2022-09-16 CN claimed
CN-111575096-B Antirust gearbox engine oil and preparation method thereof 山东零公里润滑科技有限公司 2022-09-16 CN disclosed
CN-111575096-A Antirust gearbox engine oil and preparation method thereof 许卫明 2020-08-25 CN disclosed