SCHEMBL8985399

SCHEMBL8985399

O=C(NCCCCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OCc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.49
▸ MAOB P27338 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ LMNA P02545 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ LGALS8 O00214 1/20 0.46
▸ KEAP1 Q14145 1/20 0.45
▸ NFE2L2 Q16236 1/20 0.45

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
SCHEMBL18756738 0.96 HTT (0.50) TGM2MAOBHTTLMNASMN1; SMN2
SCHEMBL12094113 0.94 LGALS3 (0.54) TGM2MAOBHTTLGALS8
SCHEMBL19036050 0.94 LGALS3 (0.54) TGM2MAOBHTTLGALS8
SCHEMBL12094119 0.94 LGALS3 (0.54) TGM2MAOBHTTLGALS8
SCHEMBL28333071 0.92 LMNA (0.54) MAOBHTTLMNASMN1; SMN2LGALS8
SCHEMBL30391620 0.91 HTT (0.46) TGM2MAOBHTTLMNASMN1; SMN2
SCHEMBL30891388 0.91 TGM2 (0.44) TGM2MAOBHTTLMNASMN1; SMN2
SCHEMBL30891325 0.91 HTT (0.46) TGM2MAOBHTTLMNASMN1; SMN2
SCHEMBL30891438 0.89 HTT (0.43) TGM2MAOBHTTLMNASMN1; SMN2
SCHEMBL30391867 0.89 LMNA (0.43) TGM2MAOBHTTLMNASMN1; SMN2

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
US-5491083-A SEPARATION OF BIOMASS, DIAGNOTIC ASSAY, BIOSENSORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-02-13 — — US disclosed
US-5384254-A For preparation of biosensors for medical diagnosis by immobilization og enzymes or ionic or nonionic groups E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-01-24 — — US disclosed
US-5342772-A Activating with a poly(fluoroalkyl)sugar reagent E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-08-30 — — US disclosed
US-5243037-A Compounds for medical diagnosis and biosensors E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-09-07 — — US disclosed
WO-1992005444-A1 POLY(FLUOROALKYL) SUGAR REAGENTS AND THEIR USE FOR SURFACE MODIFICATION E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-04-02 — — WO disclosed
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