SCHEMBL16708447

SCHEMBL16708447

C=CC(=O)OCC12CC3CC(C1)CC(OC(=O)C(=C)C)(C3)C2

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
THRB P10828 1/20 0.32
GAA P10253 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
SCHEMBL16708439 0.90 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AL3MBTL1THRB
SCHEMBL16708444 0.89 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1THRB
SCHEMBL17717372 0.87 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1THRB
SCHEMBL16708446 0.87 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AL3MBTL1THRB
SCHEMBL16708438 0.87 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AL3MBTL1THRB
SCHEMBL677131 0.83 SCN9A (0.35) ALDH1A1MEN1KMT2AL3MBTL1THRB
SCHEMBL16708445 0.83 NAAA (0.30) ALDH1A1MEN1KMT2A
SCHEMBL822920 0.81 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AL3MBTL1THRB
SCHEMBL12409923 0.81 ALDH1A1 (0.33) ALDH1A1MEN1KMT2AL3MBTL1THRB
SCHEMBL75666 0.80 GAA (0.36) ALDH1A1MEN1KMT2ATHRBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9376621-B2 Liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-06-28 US disclosed
US-9376621-B2 Liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-06-28 US disclosed
US-20150129801-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-05-14 US disclosed
US-20150129801-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-05-14 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-20150129801-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE BACE1, DRD1, CHRM1 ALDH1A1 934/4885MEN1 1095/4885KMT2A 3283/4885

“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.