SCHEMBL24933465

SCHEMBL24933465

CCCCC[C@H](C)C(C)=N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.52
OPRM1 P35372 1/20 0.44
FDPS P14324 4/20 0.43
ACE2 Q9BYF1 1/20 0.42
SPHK1 Q9NYA1 2/20 0.41
LMNA P02545 2/20 0.41
TP53 P04637 2/20 0.40
CYP2D6 P10635 2/20 0.39
GMNN O75496 1/20 0.39
POLB P06746 1/20 0.39
THPO P40225 1/20 0.39
MTOR P42345 1/20 0.39
BLM P54132 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
CETP P11597 1/20 0.39
HTT P42858 1/20 0.39
UBE2N P61088 1/20 0.39

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
SCHEMBL20143627 1.00 CA1 (0.52) CA1OPRM1FDPSACE2SPHK1
SCHEMBL28520590 0.92
SCHEMBL31322932 0.81 CA1 (0.48) CA1OPRM1FDPSACE2SPHK1
SCHEMBL101401 0.79 CA1 (0.56) CA1OPRM1FDPSACE2SPHK1
SCHEMBL27863219 0.78 CA1 (0.50) CA1OPRM1FDPSACE2SPHK1
SCHEMBL5711695 0.78 CA1 (0.45) CA1OPRM1FDPSACE2SPHK1
SCHEMBL20520253 0.77 CA1 (0.54) CA1OPRM1FDPSACE2SPHK1
SCHEMBL2301401 0.77 CA1 (0.54) CA1OPRM1FDPSACE2SPHK1
SCHEMBL20520239 0.77 CA1 (0.54) CA1OPRM1FDPSACE2SPHK1
SCHEMBL20520255 0.77 CA1 (0.54) CA1OPRM1FDPSACE2SPHK1

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-20230020092-A1 COMPOSITIONS FOR DELIVERY OF ANTISENSE COMPOUNDS ENTRADA THERAPEUTICS, INC. 2023-01-19 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-20230020092-A1 COMPOSITIONS FOR DELIVERY OF ANTISENSE COMPOUNDS HNRNPAB, SNRPE, HNRNPA2B1 CA1 4679/4885OPRM1 3732/4885FDPS 3868/4885

“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.