SCHEMBL21667765

SCHEMBL21667765

CCN(CC(=O)OC(C)C)C(C)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
TSHR P16473 2/20 0.39
ALDH1A1 P00352 3/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
CHRM2 P08172 2/20 0.33
CHRM4 P08173 2/20 0.33
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSPO P30536 1/20 0.31
POLB P06746 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 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
SCHEMBL21667764 0.85 LMNA (0.43) LMNATSHRALDH1A1TP53HPGD
SCHEMBL20146723 0.79 LMNA (0.54) LMNAALDH1A1MAPT
SCHEMBL3167085 0.78 TSHR (0.34) LMNATSHRCHRM2CHRM4CHRM5
SCHEMBL20125938 0.78 PSMB5 (0.38) LMNATSHRALDH1A1TP53HPGD
SCHEMBL3227461 0.77 LMNA (0.45) LMNATSHRALDH1A1CHRM2CHRM4
SCHEMBL12424101 0.77 MGAM (0.48) LMNATSHRALDH1A1SMN1; SMN2MEN1
SCHEMBL26300313 0.77 TSHR (0.38) LMNATSHRALDH1A1CHRM2CHRM4
SCHEMBL12230753 0.76 LMNA (0.43) LMNATSHRALDH1A1SMN1; SMN2CYP2D6
SCHEMBL21667825 0.75 TSHR (0.42) LMNATSHRALDH1A1CHRM1SMN1; SMN2
SCHEMBL14281116 0.75 CA12 (0.47) LMNATSHRALDH1A1TP53SMN1; SMN2

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-20200038309-A1 COMPOSITION, ARTIFICIAL NAIL COMPOSITION, NAIL DECORATION MATERIAL, ARTIFICIAL NAIL, STORED CONTAINER, IMAGE FORMING APPARATUS, AND IMAGE FORMING METHOD RICOH COMPANY, LTD. (JP) 2020-02-06 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-20200038309-A1 COMPOSITION, ARTIFICIAL NAIL COMPOSITION, NAIL DECORATION MATERIAL, ARTIFICIAL NAIL, STORED CONTAINER, IMAGE FORMING APPARATUS, AND IMAGE FORMING METHOD NACA, PIK3C3, DPM1 LMNA 3384/4885TSHR 1601/4885ALDH1A1 1704/4885

“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.