SCHEMBL24913301

SCHEMBL24913301

CC(C)CCNC(=O)C(C)(C)CCO

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.40
ANPEP P15144 4/20 0.39
RNPEP Q9H4A4 3/20 0.39
DNPEP Q9ULA0 3/20 0.39
SMN1; SMN2 Q16637 4/20 0.37
RAB9A P51151 3/20 0.37
GAA P10253 1/20 0.37
NPC1 O15118 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CNR2 P34972 1/20 0.34
CCR2 P41597 1/20 0.34
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MMP2 P08253 1/20 0.33
MMP8 P22894 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
SCHEMBL23734275 0.85 ANPEP (0.41) CNR1ANPEPRNPEPDNPEPSMN1; SMN2
SCHEMBL21763558 0.79 ANPEP (0.40) CNR1ANPEPRNPEPDNPEPSMN1; SMN2
SCHEMBL24126081 0.79 CNR1 (0.43) CNR1SMN1; SMN2HSD17B10
SCHEMBL19509788 0.79 CNR1 (0.50) CNR1MMP2
SCHEMBL12015001 0.78 ANPEP (0.44) CNR1ANPEPRNPEPDNPEPSMN1; SMN2
SCHEMBL21696331 0.76 RAB9A (0.38) CNR1ANPEPRNPEPDNPEPSMN1; SMN2
SCHEMBL17447468 0.76 CCR2 (0.39) CNR1ANPEPRNPEPDNPEPL3MBTL1
SCHEMBL24678335 0.76 CNR1 (0.55) CNR1MMP2
SCHEMBL24873174 0.75 ANPEP (0.37) CNR1ANPEPRNPEPDNPEPSMN1; SMN2
SCHEMBL1310832 0.75 ANPEP (0.46) CNR1ANPEPRNPEPDNPEPSMN1; 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-20230028321-A1 NUCLEOTIDE DERIVATIVES AND METHODS OF USE THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2023-01-26 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-20230028321-A1 NUCLEOTIDE DERIVATIVES AND METHODS OF USE THEREOF POLRMT, NSUN2, NUDT1 CNR1 3543/4885ANPEP 1229/4885RNPEP 556/4885

“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.