SCHEMBL26324104

SCHEMBL26324104

CCOC(=O)/C=C/CC1COC(C)(C)O1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 2/20 0.38
HCAR2 Q8TDS4 1/20 0.38
NPSR1 Q6W5P4 2/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
TTR P02766 1/20 0.35
DPP4 P27487 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.33
TMEM97 Q5BJF2 2/20 0.33
SIGMAR1 Q99720 2/20 0.33

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
SCHEMBL17888069 1.00 CA2 (0.39) CA2MAPTALDH1A1HCAR2NPSR1
SCHEMBL24326319 0.85 CA2 (0.41) CA2ALDH1A1HCAR2NPSR1TMEM97
SCHEMBL17888093 0.81 CHRM2 (0.40) CA2MAPTALDH1A1HCAR2CTDSP1
SCHEMBL23927697 0.80 CA2 (0.41) CA2ALDH1A1NPSR1TMEM97SIGMAR1
SCHEMBL5973123 0.80 CA2 (0.41) CA2ALDH1A1NPSR1TMEM97SIGMAR1
SCHEMBL23927695 0.80 CA2 (0.41) CA2ALDH1A1NPSR1TMEM97SIGMAR1
SCHEMBL15701848 0.77 CA2 (0.51) CA2ALDH1A1HCAR2NPSR1CTDSP1
SCHEMBL4422593 0.77 L3MBTL1 (0.45) CA2MAPTALDH1A1HCAR2NPSR1
SCHEMBL1243883 0.77 L3MBTL1 (0.45) CA2MAPTALDH1A1HCAR2NPSR1
SCHEMBL3988831 0.77 L3MBTL1 (0.45) CA2MAPTALDH1A1HCAR2NPSR1

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-20230278955-A1 VITAMIN D3 DERIVATIVES AND PHARMACEUTICAL USE THEREOF UNIV KYOTO (JP) 2023-09-07 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-20230278955-A1 VITAMIN D3 DERIVATIVES AND PHARMACEUTICAL USE THEREOF VDR, CYP24A1, CYP2R1 CA2 4061/4885MAPT 4051/4885ALDH1A1 256/4885

“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.