SCHEMBL16640651

SCHEMBL16640651

CCC1O[C@@H](OCc2ccccc2)C(C)[C@@H](C)[C@@H]1O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.40
SSTR5 P35346 2/20 0.38
SLC5A2 P31639 2/20 0.38
FGF1 P05230 2/20 0.37
FGF2 P09038 2/20 0.37
VEGFA P15692 2/20 0.37
HPSE Q9Y251 2/20 0.37
LGALS8 O00214 1/20 0.37
PDE4D Q08499 1/20 0.36
SSTR1 P30872 1/20 0.36
SSTR2 P30874 1/20 0.36
SSTR4 P31391 1/20 0.36
SSTR3 P32745 1/20 0.36
NT5E P21589 1/20 0.35

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
SCHEMBL17147995 0.91 SLC6A2 (0.40) SLC6A2SSTR5SLC5A2FGF1FGF2
SCHEMBL4404459 0.89 SLC6A2 (0.40) SLC6A2SSTR5SLC5A2FGF1FGF2
SCHEMBL15280895 0.87 FGF1 (0.39) SLC6A2SSTR5FGF1FGF2VEGFA
SCHEMBL25912875 0.86 SLC6A2 (0.49) SLC6A2SSTR5PDE4DSSTR1SSTR2
SCHEMBL14903581 0.85 SLC5A2 (0.47) SLC6A2SLC5A2
SCHEMBL14903579 0.85 SLC5A2 (0.47) SLC6A2SLC5A2
SCHEMBL15504371 0.85 SLC5A2 (0.47) SLC6A2SLC5A2
SCHEMBL9925406 0.83 SLC6A2 (0.46) SLC6A2SSTR5SLC5A2FGF1FGF2
SCHEMBL18653425 0.83 SLC6A2 (0.44) SLC6A2SSTR5FGF1FGF2VEGFA
SCHEMBL16640650 0.81 L3MBTL1 (0.46) SSTR5SSTR1SSTR2SSTR4SSTR3

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-20150104479-A1 MENINGOCOCCUS SEROGROUP X CONJUGATE NOVARTIS AG (CH) 2015-04-16 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-20150104479-A1 MENINGOCOCCUS SEROGROUP X CONJUGATE O60361, MLEC, PDHX SLC6A2 3789/4885SSTR5 4050/4885SLC5A2 2875/4885

“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.