SCHEMBL16171989

SCHEMBL16171989

CCC(N)C(=O)N(C(C)C)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 3/20 0.35
SLC1A2 P43004 3/20 0.35
SLC1A1 P43005 2/20 0.35
SLC7A5 Q01650 1/20 0.34
DPP4 P27487 3/20 0.33
DPP8 Q6V1X1 2/20 0.33
DPP9 Q86TI2 2/20 0.33
DPP7 Q9UHL4 2/20 0.33
FAP Q12884 1/20 0.33
GCLC P48506 1/20 0.32
LAP3 P28838 1/20 0.31
SLC15A1 P46059 1/20 0.31
TP53 P04637 1/20 0.30
KIF11 P52732 1/20 0.30
GABRP O00591 2/20 0.30
GABRD O14764 2/20 0.30
GABRA1 P14867 2/20 0.30
GABRB1 P18505 2/20 0.30
GABRG2 P18507 2/20 0.30
GABRB3 P28472 2/20 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
SCHEMBL16172007 0.82 SLC1A2 (0.39) SLC1A3SLC1A2SLC1A1DPP4DPP8
SCHEMBL18774973 0.79 SLC7A5 (0.54) SLC1A3SLC1A2SLC1A1SLC7A5DPP4
Hydrochloric Acid SCHEMBL10925209 0.79 ALDH1A1 (0.33) SLC1A3SLC1A2SLC1A1SLC7A5
SCHEMBL12709890 0.79 SLC1A3 (0.34) SLC1A3SLC1A2SLC1A1SLC7A5DPP4
SCHEMBL16240143 0.77 BHMT (0.38) SLC1A3SLC1A2SLC1A1SLC7A5DPP4
SCHEMBL9366113 0.77 BHMT (0.38) SLC1A3SLC1A2SLC1A1SLC7A5DPP4
SCHEMBL23079085 0.75 TSHR (0.32)
SCHEMBL21611742 0.75 TSHR (0.37) SLC1A3SLC1A2SLC1A1GCLCTP53
SCHEMBL2929108 0.75
SCHEMBL1189930 0.75

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-20140308304-A1 LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS ALNYLAM PHARMACEUTICALS, INC. 2014-10-16 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-20140308304-A1 LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS NPC1L1, NPC1, CETP SLC1A3 2141/4885SLC1A2 3240/4885SLC1A1 2306/4885

“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.