SCHEMBL9908813

SCHEMBL9908813

CC1C(O)[C@H](O[C@@H]2O[C@@H](OC=O)[C@@H](O[C@H]3OC(COS(=O)(=O)O)[C@@H](O[C@@H]4OC(C(=O)O)[C@@H](O)[C@H](O)C4O)[C@H](O)C3C)C(O)C2O)[C@H](COS(=O)(=O)O)O[C@@H]1OCCCCCN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BDNF P23560 3/20 0.50
PTN P21246 2/20 0.50
MDK P21741 2/20 0.50
F10 P00742 1/20 0.41
BMP2 P12643 3/20 0.39
VEGFA P15692 3/20 0.39
IFNG P01579 2/20 0.39
FGF1 P05230 1/20 0.39
FGF2 P09038 1/20 0.39
SFRP1 Q8N474 1/20 0.39
IGF2R P11717 1/20 0.37
CXCL12 P48061 3/20 0.37
SHH Q15465 2/20 0.37
PF4 P02776 2/20 0.37
CCL2 P13500 2/20 0.37
SELP P16109 1/20 0.37
BMP6 P22004 1/20 0.37
CCL11 P51671 1/20 0.37
WNT3A P56704 1/20 0.37
SELPLG Q14242 1/20 0.37

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
SCHEMBL9908822 0.95 BDNF (0.50) BDNFPTNMDKF10BMP2
SCHEMBL9908818 0.95 BDNF (0.51) BDNFPTNMDKF10BMP2
SCHEMBL9908817 0.89 BDNF (0.40) BDNFPTNMDKF10BMP2
SCHEMBL9908821 0.88 BDNF (0.42) BDNFPTNMDKF10BMP2
SCHEMBL17167541 0.80 BDNF (0.54) BDNFPTNMDKF10BMP2
SCHEMBL17167553 0.76 BDNF (0.55) BDNFPTNMDKF10BMP2
SCHEMBL19276944 0.74 LGALS8 (0.60) BDNFPTNMDKBMP2VEGFA
SCHEMBL17636508 0.74 LGALS8 (0.60) BDNFPTNMDKBMP2VEGFA
SCHEMBL19276942 0.74 LGALS8 (0.60) BDNFPTNMDKBMP2VEGFA
SCHEMBL19272037 0.74 LGALS8 (0.60) BDNFPTNMDKBMP2VEGFA

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-20160060365-A1 HEPARAN SULFATE SYNTHESIS UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2016-03-03 US disclosed
US-20120142560-A1 HEPARAN SULFATE SYNTHESIS UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2012-06-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160060365-A1 HEPARAN SULFATE SYNTHESIS HPSE, STT3B, DDOST BDNF 2146/4885PTN 335/4885MDK 1133/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.