SCHEMBL10648977

SCHEMBL10648977

CCCCCO[C@H]1[C@H](OCCCCC)[C@@H](OCCCCC)C(OC)O[C@@H]1CO

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TNF P01375 2/20 0.51
▸ MAPK1 P28482 1/20 0.44
▸ GJB2 P29033 1/20 0.43
▸ GBA1 P04062 3/20 0.42
▸ SSTR1 P30872 1/20 0.40
▸ SSTR2 P30874 1/20 0.40
▸ SSTR4 P31391 1/20 0.40
▸ SSTR3 P32745 1/20 0.40
▸ SSTR5 P35346 1/20 0.40
▸ LGALS8 O00214 3/20 0.37
▸ LGALS3 P17931 1/20 0.37
▸ LGALS4 P56470 1/20 0.37
▸ SLC2A1 P11166 1/20 0.35
▸ TLR4 O00206 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
SCHEMBL15003149 0.95 TNF (0.46) TNFMAPK1GJB2GBA1SSTR1
SCHEMBL14418209 0.95 TNF (0.46) TNFMAPK1GJB2GBA1SSTR1
SCHEMBL12669339 0.95 TNF (0.46) TNFMAPK1GJB2GBA1SSTR1
SCHEMBL463607 0.95 TNF (0.46) TNFMAPK1GJB2GBA1SSTR1
SCHEMBL15304386 0.95 TNF (0.46) TNFMAPK1GJB2GBA1SSTR1
SCHEMBL15003220 0.95 TNF (0.46) TNFMAPK1GJB2GBA1SSTR1
SCHEMBL12898607 0.95 TNF (0.46) TNFMAPK1GJB2GBA1SSTR1
SCHEMBL9008143 0.95 TNF (0.46) TNFMAPK1GJB2GBA1SSTR1
SCHEMBL16254154 0.94 TNF (0.47) TNFMAPK1GJB2GBA1SSTR1
SCHEMBL27099540 0.94 TNF (0.47) TNFMAPK1GJB2GBA1SSTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4745186-A DIETETICS BITTER TASTE IN COSMETICS PLANT CELL RESEARCH INSTITUTE, INC. (US) 1988-05-17 — — US disclosed
EP-0194154-A2 2,3,4-Triacylhexoses and mixtures thereof PLANT CELL RESEARCH INSTITUTE, INC. (US) 1986-09-10 — — EP disclosed
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