SCHEMBL20976830

SCHEMBL20976830

COC1OC(COC2OC(COC(=O)[C@H](CCCSC)[C@@H](C)O)C(O)C2O)C(OC2O[C@H](COC(=O)[C@H](CCSC)[C@@H](C)O)C(O)C2O)C1O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR4 O00206 1/20 0.35
▸ F10 P00742 4/20 0.34
▸ FGF1 P05230 1/20 0.32
▸ CD209 Q9NNX6 2/20 0.32
▸ MARS1 P56192 4/20 0.31
▸ LGALS3 P17931 2/20 0.31
▸ ENGASE Q8NFI3 1/20 0.31
▸ PRKD3 O94806 1/20 0.31
▸ PRKCG P05129 1/20 0.31
▸ PRKCB P05771 1/20 0.31
▸ PRKCA P17252 1/20 0.31
▸ PRKCH P24723 1/20 0.31
▸ PRKCI P41743 1/20 0.31
▸ PRKCE Q02156 1/20 0.31
▸ PRKCQ Q04759 1/20 0.31
▸ PRKCZ Q05513 1/20 0.31
▸ PRKCD Q05655 1/20 0.31
▸ PRKD1 Q15139 1/20 0.31
▸ LGALS9 O00182 1/20 0.30
▸ LGALS1 P09382 1/20 0.30

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
SCHEMBL18513195 0.81 FGF1 (0.39) TLR4F10FGF1CD209LGALS3
SCHEMBL20976854 0.76 TLR4 (0.36) TLR4F10FGF1CD209LGALS3
SCHEMBL19273656 0.68 PRKD3 (0.45) TLR4LGALS3PRKD3PRKCGPRKCB
SCHEMBL20976829 0.67 ALDH1A1 (0.31) MARS1
SCHEMBL29344800 0.66 CD209 (0.49) F10FGF1CD209LGALS3ENGASE
SCHEMBL15316732 0.66 LGALS3 (0.55) FGF1CD209LGALS3ENGASELGALS9
SCHEMBL16688327 0.65 CD209 (0.54) FGF1CD209LGALS3ENGASELGALS9
SCHEMBL13290316 0.65 CD209 (0.60) FGF1CD209LGALS3ENGASELGALS9
SCHEMBL17830236 0.65 CD209 (0.60) FGF1CD209LGALS3ENGASELGALS9
SCHEMBL6815714 0.65 CD209 (0.60) FGF1CD209LGALS3ENGASELGALS9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3335045-B1 COMPOSITIONS AND METHODS DIAGNOSTIG LTD (GB) 2019-05-08 — — EP disclosed
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