SCHEMBL25769656

SCHEMBL25769656

CN(C)CCOCCOCC(N)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRNB2 P17787 1/20 0.42
CHRM3 P20309 1/20 0.42
CHRNA4 P43681 1/20 0.42
OPRK1 P41145 1/20 0.41
KDM4E B2RXH2 10/20 0.39
ALDH1A1 P00352 5/20 0.39
DNM1 Q05193 1/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RAB9A P51151 1/20 0.37
TDP1 Q9NUW8 2/20 0.37

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
SCHEMBL11204657 0.96 CHRM2 (0.45) CA12CA1CA2CA9CHRM2
SCHEMBL7718808 0.83 CA12 (0.44) CA12CA1CA2CA9CHRM2
SCHEMBL8893027 0.83 CA12 (0.47) CA12CA1CA2CA9CHRM2
SCHEMBL22325195 0.82 CES2 (0.36) KDM4EALDH1A1BLMPMP22HSD17B10
SCHEMBL6712841 0.82 CES2 (0.36) KDM4EALDH1A1BLMPMP22HSD17B10
SCHEMBL30661132 0.82 CES2 (0.36) KDM4EALDH1A1BLMPMP22HSD17B10
SCHEMBL6668639 0.82 CES2 (0.36) KDM4EALDH1A1BLMPMP22HSD17B10
SCHEMBL24784667 0.81 BLM (0.48) CA12CA1CA2CA9CHRM2
SCHEMBL280516 0.81 CA12 (0.46) CA12CA1CA2CA9CHRM2
SCHEMBL29638790 0.81 BLM (0.48) CA12CA1CA2CA9CHRM2

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-20230203030-A1 COMPOUNDS AND METHODS FOR THE ENHANCED DEGRADATION OF TARGETED PROTEINS ARVINAS OPERATIONS, INC. 2023-06-29 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-20230203030-A1 COMPOUNDS AND METHODS FOR THE ENHANCED DEGRADATION OF TARGETED PROTEINS VHL, MDM2, XIAP CA12 3306/4885CA1 2530/4885CA2 3129/4885

“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.