SCHEMBL25893154

SCHEMBL25893154

CC1(C)OC[C@H](CCOC(=O)c2ccccc2)O1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
TMEM97 Q5BJF2 2/20 0.46
SIGMAR1 Q99720 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 1/20 0.44
ADORA3 P0DMS8 1/20 0.42
HTR1A P08908 2/20 0.41
ADRA1D P25100 2/20 0.41
ADRA1A P35348 2/20 0.41
ADRA1B P35368 2/20 0.41
NPC1 O15118 1/20 0.40
NAMPT P43490 3/20 0.40
SCN1A P35498 1/20 0.39
SCN2A Q99250 1/20 0.39
SCN3A Q9NY46 1/20 0.39

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
SCHEMBL25891804 1.00 LMNA (0.48) LMNATMEM97SIGMAR1TDP1ALDH1A1
SCHEMBL18288401 1.00 LMNA (0.48) LMNATMEM97SIGMAR1TDP1ALDH1A1
SCHEMBL2493185 0.86 ALDH1A1 (0.52) TMEM97SIGMAR1ALDH1A1NPC1
SCHEMBL6933031 0.86 ALDH1A1 (0.52) TMEM97SIGMAR1ALDH1A1NPC1
SCHEMBL9098184 0.86 ALDH1A1 (0.52) TMEM97SIGMAR1ALDH1A1NPC1
SCHEMBL17888100 0.80 TBXA2R (0.43) LMNATMEM97SIGMAR1ALDH1A1NAMPT
SCHEMBL25417926 0.80 TMEM97 (0.49) LMNATMEM97SIGMAR1TDP1NAMPT
SCHEMBL19136746 0.80 KMT2A (0.49) LMNATMEM97SIGMAR1ALDH1A1NPC1
SCHEMBL4361938 0.78 CA2 (0.45) TMEM97SIGMAR1ALDH1A1HTR1ANAMPT
SCHEMBL17830008 0.78 HTR7 (0.47) TMEM97SIGMAR1ALDH1A1NPC1NAMPT

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-20230242480-A1 Alkyne Compound, Vitamin D Compound, Analytical Method, and Production Method JEOL LTD. (JP) 2023-08-03 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-20230242480-A1 Alkyne Compound, Vitamin D Compound, Analytical Method, and Production Method VDR, CYP2R1, CYP24A1 LMNA 1250/4885TMEM97 3274/4885SIGMAR1 1995/4885

“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.