SCHEMBL8239820

SCHEMBL8239820

O=C1N[C@H]2[C@H](CS[C@H]2CCCCCNCCOCCO[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@H](O)[CH][C@@H]2O)N1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGF1 P05230 1/20 0.51
▸ FGF2 P09038 1/20 0.51
▸ VEGFA P15692 1/20 0.51
▸ HPSE Q9Y251 1/20 0.51
▸ MDK P21741 4/20 0.50
▸ HLCS P50747 2/20 0.41
▸ PKM P14618 2/20 0.40
▸ F2 P00734 1/20 0.39
▸ PRSS1 P07477 1/20 0.39
▸ PRSS2 P07478 1/20 0.39
▸ PRSS3 P35030 1/20 0.39
▸ TPSAB1 Q15661 1/20 0.39
▸ FOLH1 Q04609 2/20 0.39
▸ TDP1 Q9NUW8 5/20 0.38
▸ PLCD1 P51178 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ ABL1 P00519 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ IDE P14735 1/20 0.36
▸ MAPK1 P28482 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
SCHEMBL8239553 1.00 FGF1 (0.51) FGF1FGF2VEGFAHPSEMDK
SCHEMBL9898615 0.77 MDK (0.65) FGF1FGF2VEGFAHPSEMDK
SCHEMBL9898618 0.77 MDK (0.65) FGF1FGF2VEGFAHPSEMDK
SCHEMBL9898612 0.77 MDK (0.65) FGF1FGF2VEGFAHPSEMDK
SCHEMBL2359254 0.75 HLCS (0.65) HLCSPKMF2PRSS1PRSS2
SCHEMBL2359251 0.74 HLCS (0.56) HLCSPKMF2PRSS1PRSS2
SCHEMBL16264872 0.71 MDK (0.75) FGF1FGF2VEGFAHPSEMDK
SCHEMBL18653674 0.71 MDK (0.75) FGF1FGF2VEGFAHPSEMDK
SCHEMBL4965567 0.67 HLCS (0.57) HPSEHLCSPKMF2PRSS1
SCHEMBL19409062 0.67 TDP1 (0.56) HLCSPKMF2PRSS1PRSS2

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
WO-2011019419-A1 CARBOHYDRATE-MEDIATED TUMOR TARGETING ARIZONA BOARD OF REGENTS, A BODY CORPORATE OF THE STATE OF ARIZONA ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2011-02-17 — — WO claimed
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