SCHEMBL13596920

SCHEMBL13596920

C=CCCC1OC(COS(=O)(=O)O)C(OSOOO)C(OC2OC(C(=O)O)C(OC3OC(COS(=O)(=O)O)C(OSOOO)C(OC4OC(C(=O)O)C(O)C(O)C4O)C3NC(C)=O)C(O)C2O)C1NC(C)=O

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MDK P21741 6/20 0.54
BDNF P23560 3/20 0.54
PTN P21246 2/20 0.54
F10 P00742 2/20 0.44
FGF2 P09038 6/20 0.40
HPSE Q9Y251 2/20 0.36
BMP2 P12643 2/20 0.35
VEGFA P15692 2/20 0.35
CXCL12 P48061 2/20 0.35
SHH Q15465 2/20 0.35
IFNG P01579 1/20 0.35
PF4 P02776 1/20 0.35
CCL2 P13500 1/20 0.35
SELP P16109 1/20 0.35
BMP6 P22004 1/20 0.35
CCL11 P51671 1/20 0.35
WNT3A P56704 1/20 0.35
SELPLG Q14242 1/20 0.35
SERPINC1 P01008 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
SCHEMBL13431447 0.90 MDK (0.58) MDKBDNFPTNF10FGF2
SCHEMBL13596935 0.90 MDK (0.58) MDKBDNFPTNF10FGF2
SCHEMBL13431463 0.87 MDK (0.56) MDKBDNFPTNF10FGF2
SCHEMBL13321923 0.86 BDNF (0.54) MDKBDNFPTNF10FGF2
SCHEMBL14414765 0.84 BDNF (0.53) MDKBDNFPTNF10FGF2
SCHEMBL13321927 0.84 MDK (0.51) MDKBDNFPTNF10FGF2
SCHEMBL13596899 0.81 MDK (0.50) MDKBDNFPTNF10FGF2
SCHEMBL13596930 0.81 MDK (0.54) MDKBDNFPTNF10FGF2
SCHEMBL13431400 0.79 MDK (0.55) MDKBDNFPTNF10FGF2
SCHEMBL13596864 0.79 MDK (0.72) MDKBDNFPTNF10FGF2

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
US-7638503-B2 Small molecule stimulators of neuronal growth CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2009-12-29 US disclosed