SCHEMBL5107294

SCHEMBL5107294

CC(OC(N)=O)C(C)(C)O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.40
TSHR P16473 4/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
CYP2C9 P11712 1/20 0.40
MAPT P10636 1/20 0.39
HSD17B10 Q99714 1/20 0.34
CYP3A4 P08684 1/20 0.33
NFKB1 P19838 1/20 0.33
ADRA1A P35348 1/20 0.33
RAB9A P51151 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL5107291 1.00 LMNA (0.40) LMNATSHRCHRM2CHRM4CHRM5
SCHEMBL16987582 0.82 LMNA (0.41) LMNATSHRCHRM2CHRM4CHRM5
SCHEMBL5665771 0.82 LMNA (0.41) LMNATSHRCHRM2CHRM4CHRM5
SCHEMBL19500214 0.82 LMNA (0.41) LMNATSHRCHRM2CHRM4CHRM5
SCHEMBL12493193 0.78 LMNA (0.39) LMNATSHRCHRM2CHRM4CHRM5
SCHEMBL528013 0.78 LMNA (0.39) LMNATSHRCHRM2CHRM4CHRM5
SCHEMBL16250316 0.77 TSHR (0.50) TSHRCHRM2CHRM4CHRM1MAPT
SCHEMBL10297387 0.77 TSHR (0.50) TSHRCHRM2CHRM4CHRM1MAPT
SCHEMBL10297388 0.77 TSHR (0.50) TSHRCHRM2CHRM4CHRM1MAPT
SCHEMBL27891086 0.76 LMNA (0.38) LMNATSHRCHRM2CHRM4CHRM5

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-7449581-B2 6-Substituted pyrido-pyrimidines POCHE PALO ALTO LLC (US) 2008-11-11 US disclosed
US-20070135458-A1 6-Substituted pyrido-pyrimidines CHEN JIAN J 2007-06-14 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-20070135458-A1 6-Substituted pyrido-pyrimidines P2RX6, P2RX1, P2RX7 LMNA 2628/4885TSHR 891/4885CHRM2 350/4885

“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.