SCHEMBL21740323

SCHEMBL21740323

CC(C)(CN)CC(C)(C)OCCC(C)(C)C(N)=O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
CYP2D6 P10635 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL25850693 0.79
SCHEMBL14094680 0.76 KDM4E (0.44) KDM4ECYP2D6LMNAHSD17B10
SCHEMBL17381349 0.76 LMNA (0.41) LMNAHSD17B10
SCHEMBL23868445 0.74 LMNA (0.33) LMNAHSD17B10
SCHEMBL20415943 0.74
SCHEMBL21740369 0.73
SCHEMBL22340364 0.73 LMNA (0.47) LMNAHSD17B10
SCHEMBL21083165 0.72 ACLY (0.37) KDM4E
SCHEMBL22340464 0.71
SCHEMBL22340346 0.71 LMNA (0.34) LMNAHSD17B10

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-20200054739-A1 CONJUGATED VACCINES SUTROVAX, INC. 2020-02-20 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-20200054739-A1 CONJUGATED VACCINES ASNS, CD14, CD74 KDM4E 4357/4885CYP2D6 3425/4885LMNA 4333/4885

“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.