SCHEMBL14224776

SCHEMBL14224776

CCCCC1COC(c2ccccc2)OC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43
GRM2 Q14416 5/20 0.40
TSHR P16473 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
DRD2 P14416 1/20 0.37
DPP4 P27487 2/20 0.36

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
SCHEMBL13381352 0.89 MEN1 (0.46) MEN1CYP2C19KMT2ATSHRHRH3
SCHEMBL9556209 0.85 HRH3 (0.40) MEN1CYP2C19KMT2AGRM2TSHR
SCHEMBL9556211 0.85 HRH3 (0.40) MEN1CYP2C19KMT2AGRM2TSHR
SCHEMBL8997203 0.83 GRM2 (0.38) GRM2
SCHEMBL10800140 0.83 GRM2 (0.39) CYP2C19GRM2TSHRDRD2
SCHEMBL8997302 0.83 MAPK1 (0.41) GRM2DRD2
SCHEMBL12695232 0.83 CYP3A4 (0.43) CYP2C19TSHR
SCHEMBL13381248 0.82 MEN1 (0.48) MEN1CYP2C19KMT2ATSHRDRD2
SCHEMBL9578525 0.82 RARB (0.41) MEN1KMT2ATSHR
SCHEMBL10640546 0.81 CYP2C9 (0.44) MEN1CYP2C19KMT2ATSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7354950-B2 1,3-Dioxane derivatives, composition, optical element and display device containing the same FUJIFILM CORPORATION (JP) 2008-04-08 US disclosed
US-20070194278-A1 1,3-Dioxane derivatives, composition, optical element and display device containing the same FUJIFILM CORPORATION 2007-08-23 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-20070194278-A1 1,3-Dioxane derivatives, composition, optical element and display device containing the same DDR1, CRY1, CXCR1 MEN1 461/4885CYP2C19 715/4885KMT2A 2874/4885

“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.