SCHEMBL8023508

SCHEMBL8023508

CC(=O)N[C@H]1C(OC(C)=O)O[C@H](CO)[C@@H](F)[C@@H]1OC(C)=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.42
▸ THRB P10828 1/20 0.42
▸ POLB P06746 2/20 0.42
▸ MAPK1 P28482 2/20 0.41
▸ CYP3A4 P08684 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ CD69 Q07108 1/20 0.39
▸ LGALS8 O00214 1/20 0.37
▸ LGALS3 P17931 1/20 0.37
▸ LGALS4 P56470 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ TLR4 O00206 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL8023515 1.00 LMNA (0.45) LMNAKMT2AALDH1A1THRBPOLB
SCHEMBL24140922 0.88 LMNA (0.44) LMNAKMT2AALDH1A1THRBPOLB
SCHEMBL10687435 0.87 LMNA (0.53) LMNAKMT2AALDH1A1THRBPOLB
SCHEMBL6324521 0.87 LMNA (0.53) LMNAKMT2AALDH1A1THRBPOLB
SCHEMBL6324514 0.87 LMNA (0.53) LMNAKMT2AALDH1A1THRBPOLB
SCHEMBL912858 0.86 LMNA (0.56) LMNAKMT2AALDH1A1THRBPOLB
SCHEMBL912857 0.86 LMNA (0.56) LMNAKMT2AALDH1A1THRBPOLB
SCHEMBL29586206 0.86 LMNA (0.56) LMNAKMT2AALDH1A1THRBPOLB
SCHEMBL7154639 0.84 ALDH1A1 (0.52) LMNAKMT2AALDH1A1THRBPOLB
SCHEMBL7154645 0.84 ALDH1A1 (0.52) LMNAKMT2AALDH1A1THRBPOLB

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
EP-0711766-B1 7-FLUORO-2, 3-DIDEHYDROSIALIC ACID AND INTERMEDIATE FOR SYNTHESIS THEREOF DAIKIN IND LTD (JP) 2000-02-16 — — EP disclosed
US-5627290-A 2,3-didehydrosialic acid substituted with fluorine at 7-position and synthetic intermediate thereof DAIKIN INDUSTRIES, LTD. (JP) 1997-05-06 — — US disclosed
EP-0711766-A1 7-FLUORO-2, 3-DIDEHYDROSIALIC ACID AND INTERMEDIATE FOR SYNTHESIS THEREOF DAIKIN INDUSTRIES, LIMITED (JP) 1996-05-15 — — EP disclosed
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