SCHEMBL21398360

SCHEMBL21398360

C=C(CO)C(=O)OCC(COC(=O)C(C)C)CC1CCC2CC(CCC3CCC(CCCCC)CC3)CCC2C1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL19854787 0.91 TSHR (0.34)
SCHEMBL19855637 0.87 TSHR (0.34) MAPT
SCHEMBL19856030 0.84 TSHR (0.36) TP53MAPT
SCHEMBL19853816 0.83 TSHR (0.37) TP53MAPT
SCHEMBL19854725 0.83 TSHR (0.37) TP53MAPT
SCHEMBL19855781 0.83 TP53 (0.32) TP53MAPT
SCHEMBL20882362 0.83 TP53 (0.32) TP53MAPT
SCHEMBL19856075 0.82 TSHR (0.39) TP53MAPT
SCHEMBL19854058 0.82 TSHR (0.36) TP53MAPT
SCHEMBL20882444 0.82 TP53 (0.31) TP53MAPT

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-20190292463-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORPORATION (JP) 2019-09-26 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-20190292463-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT SP1, PYM1, MPEG1 TP53 1267/4885MAPT 2338/4885

“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.