SCHEMBL19822814

SCHEMBL19822814

CC(C)COC(=O)CCC(=O)OC(C)C

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
ALDH1A1 P00352 2/20 0.43
TSHR P16473 4/20 0.42
MAPT P10636 2/20 0.40
PRKCA P17252 2/20 0.40
PRKCE Q02156 2/20 0.40
PRKCQ Q04759 2/20 0.40
PRKCD Q05655 2/20 0.40
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
NOTUM Q6P988 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL27481730 0.92 LMNA (0.60) LMNAALDH1A1TSHRMAPTPRKCA
SCHEMBL334176 0.89 TSHR (0.50) LMNAALDH1A1TSHRMAPTPRKCA
SCHEMBL30529014 0.86 TSHR (0.48) LMNAALDH1A1TSHRMAPTPRKCA
SCHEMBL27561555 0.86 TSHR (0.48) LMNAALDH1A1TSHRMAPTPRKCA
SCHEMBL72471 0.83 LMNA (0.62) LMNAALDH1A1TSHRMAPTGAA
SCHEMBL19543663 0.83 LMNA (0.46) LMNAALDH1A1MAPTPRKCAPRKCE
SCHEMBL31402602 0.81 LMNA (0.60) LMNAALDH1A1TSHRMAPTGAA
SCHEMBL846984 0.80 EGLN1 (0.45) LMNAALDH1A1TSHRMAPTPOLB
SCHEMBL3944331 0.80 TSHR (0.59) LMNAALDH1A1TSHRMAPTPOLB
SCHEMBL1533356 0.80 TSHR (0.48) LMNAALDH1A1TSHRMAPTPOLB

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-20180030342-A1 PHOTO-CROSSLINKABLE EMISSIVE MOLECULAR MATERIALS NANTES UNIVERSITE (FR) 2018-02-01 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-20180030342-A1 PHOTO-CROSSLINKABLE EMISSIVE MOLECULAR MATERIALS TYR, PNMT, INMT LMNA 1981/4885ALDH1A1 257/4885TSHR 3177/4885

“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.