SCHEMBL17068481

SCHEMBL17068481

CCCCCC1CCC(C2CCC(C3=COC(c4cc(F)c(F)c(F)c4)CC3)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
CYP1A2 P05177 1/20 0.31

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
SCHEMBL17068471 0.90 CYP2C9 (0.33) MEN1KMT2AMAPT
SCHEMBL17068483 0.85
SCHEMBL17070684 0.82
SCHEMBL7756537 0.82 MEN1 (0.37) MEN1KMT2AGAAMAPTCYP1A2
SCHEMBL3437353 0.82 MEN1 (0.37) MEN1KMT2AGAAMAPTCYP1A2
SCHEMBL7756549 0.82 MEN1 (0.37) MEN1KMT2AGAAMAPTCYP1A2
SCHEMBL8734616 0.82 MEN1 (0.37) MEN1KMT2AGAAMAPTCYP1A2
SCHEMBL9764345 0.81 MAPT (0.38) MEN1KMT2AGAAMAPTCYP1A2
SCHEMBL9763861 0.81 MAPT (0.38) MEN1KMT2AGAAMAPTCYP1A2
SCHEMBL9763955 0.81 MAPT (0.38) MEN1KMT2AGAAMAPTCYP1A2

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-9523038-B2 Dihydropyran compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-12-20 US disclosed
US-20150252264-A1 DIHYDROPYRAN COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-09-10 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-20150252264-A1 DIHYDROPYRAN COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE DRD1, CNKSR1, DRG1 MEN1 2938/4885KMT2A 3086/4885GAA 4257/4885

“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.