SCHEMBL25824227

SCHEMBL25824227

CN(C)CCCc1cccc(OCC2CCCCC2)c1

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.48
NOS1 P29475 1/20 0.47
NOS2 P35228 1/20 0.47
DUT P33316 1/20 0.45
CETP P11597 1/20 0.45
TLR4 O00206 1/20 0.44
TLR2 O60603 1/20 0.44

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
SCHEMBL29818783 1.00 SLC2A1 (0.48) SLC2A1NOS1NOS2DUTCETP
SCHEMBL4568750 0.85 SLC2A1 (0.48) SLC2A1TLR4TLR2
SCHEMBL3967742 0.85 SLC2A1 (0.48) SLC2A1TLR4TLR2
SCHEMBL4568833 0.85 SLC2A1 (0.48) SLC2A1TLR4TLR2
SCHEMBL4568850 0.84 PPARA (0.53) SLC2A1TLR4TLR2
SCHEMBL4568811 0.84 PPARA (0.49) SLC2A1TLR4TLR2
SCHEMBL1002808 0.83 TLR4 (0.46) SLC2A1TLR4TLR2
SCHEMBL30580721 0.83 TLR4 (0.46) SLC2A1TLR4TLR2
SCHEMBL2202527 0.83 TLR4 (0.46) SLC2A1TLR4TLR2
SCHEMBL2204247 0.83 TLR4 (0.46) SLC2A1TLR4TLR2

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-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2023-07-13 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-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER SLC2A1 891/4885NOS1 1659/4885NOS2 1900/4885

“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.