SCHEMBL9410305

SCHEMBL9410305

O=C(C=Cc1ccc(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)o1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.46
▸ MEN1 O00255 2/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ ADORA3 P0DMS8 1/20 0.42
▸ ADORA2A P29274 1/20 0.42
▸ HDAC4 P56524 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ SYNJ2 O15056 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ABL1 P00519 1/20 0.41

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
SCHEMBL6935298 0.80 TYR (0.46) ALDH1A1PTPN1
SCHEMBL6935306 0.80 TYR (0.46) ALDH1A1PTPN1
SCHEMBL9410324 0.80 TYR (0.46) ALDH1A1PTPN1
SCHEMBL7065715 0.77 TYR (0.55) GAA
SCHEMBL9471714 0.76 MAOB (0.52) MAOBMAPTSYNJ2KDM4EABL1
SCHEMBL9410298 0.76 MAOB (0.52) MAOBMAPTSYNJ2KDM4EABL1
SCHEMBL9410307 0.76 TYR (0.44) —
SCHEMBL9470610 0.76 TYR (0.44) —
SCHEMBL9470620 0.76 TYR (0.44) —
SCHEMBL9410311 0.76 MAOB (0.49) MAOBMAPTSMN1; SMN2SYNJ2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0426176-B1 5-(alpha-D-glucopyranosyloxymethyl)-furan-2-carboxaldehyde, its derivatives, subsequent products and process for preparation of these compounds and their use SUEDZUCKER AG (DE) 1994-03-23 — — EP claimed
US-5218098-A 5-(α-D-glucopyranosyloxymethyl)-furan-2-carboxaldehyde SUDZUCKER AG MANNHEIM/OCHSENFURT (DE) 1993-06-08 — — US claimed
EP-0426176-A2 5-(alpha-D-glucopyranosyloxymethyl)-furan-2-carboxaldehyde, its derivatives, subsequent products and process for preparation of these compounds and their use SÜDZUCKER AKTIENGESELLSCHAFT MANNHEIM/OCHSENFURT (DE) 1991-05-08 — — EP claimed
EP-0426176-B1 5-(alpha-D-glucopyranosyloxymethyl)-furan-2-carboxaldehyde, its derivatives, subsequent products and process for preparation of these compounds and their use SUEDZUCKER AG (DE) 1994-03-23 — — EP disclosed
US-5218098-A 5-(α-D-glucopyranosyloxymethyl)-furan-2-carboxaldehyde SUDZUCKER AG MANNHEIM/OCHSENFURT (DE) 1993-06-08 — — US disclosed
EP-0426176-A2 5-(alpha-D-glucopyranosyloxymethyl)-furan-2-carboxaldehyde, its derivatives, subsequent products and process for preparation of these compounds and their use SÜDZUCKER AKTIENGESELLSCHAFT MANNHEIM/OCHSENFURT (DE) 1991-05-08 — — EP disclosed
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