SCHEMBL25825654

SCHEMBL25825654

CCC(CC)COc1cccc(O[C@@H](C)CNC(=O)OC(C)(C)CC)c1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 12/20 0.46
MTNR1B P49286 12/20 0.46

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
SCHEMBL8901230 0.91 MTNR1A (0.48) MTNR1AMTNR1B
SCHEMBL4572131 0.91 MTNR1A (0.48) MTNR1AMTNR1B
SCHEMBL2203514 0.83 MTNR1A (0.48) MTNR1AMTNR1B
SCHEMBL2205709 0.83 MTNR1A (0.48) MTNR1AMTNR1B
SCHEMBL2203512 0.83 MTNR1A (0.48) MTNR1AMTNR1B
SCHEMBL25822210 0.77 KDM4E (0.49) MTNR1AMTNR1B
SCHEMBL19291521 0.77 KDM4E (0.49) MTNR1AMTNR1B
SCHEMBL25818072 0.76 MTNR1A (0.44) MTNR1AMTNR1B
SCHEMBL4569079 0.76 MTNR1A (0.44) MTNR1AMTNR1B
SCHEMBL25822208 0.76 MTNR1A (0.44) MTNR1AMTNR1B

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 MTNR1A 93/4885MTNR1B 92/4885

“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.