SCHEMBL23948364

SCHEMBL23948364

CCCC(C)CCCN1CCN(CCCN)CC1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GNAI3 P08754 1/20 0.39
GNAO1 P09471 1/20 0.39
GNAI1 P63096 1/20 0.39
SIGMAR1 Q99720 2/20 0.39
CYP2D6 P10635 1/20 0.39
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.37
TSHR P16473 1/20 0.35
ACE2 Q9BYF1 1/20 0.35

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
SCHEMBL24065813 0.87 KEAP1 (0.44) KEAP1SMN1; SMN2GNAI3GNAO1GNAI1
SCHEMBL21981137 0.85 PAOX (0.39) GNAI3GNAO1GNAI1SIGMAR1TSHR
SCHEMBL19928707 0.85 TSHR (0.38) SMN1; SMN2GNAI3GNAO1GNAI1TSHR
SCHEMBL20850661 0.82 HRH3 (0.44) SMN1; SMN2GNAI3GNAO1GNAI1TSHR
SCHEMBL24723682 0.81 HRH3 (0.48) SMN1; SMN2TSHR
SCHEMBL24723810 0.81 HRH3 (0.48) SMN1; SMN2TSHR
SCHEMBL19840405 0.80 SMN1; SMN2 (0.48) KEAP1SMN1; SMN2SIGMAR1CYP2D6ALOX15
SCHEMBL26940040 0.78 CXCR4 (0.44) SMN1; SMN2GNAI3GNAO1GNAI1SIGMAR1
SCHEMBL19407025 0.78 KEAP1 (0.47) KEAP1SMN1; SMN2SIGMAR1TSHR
SCHEMBL1861653 0.78 KEAP1 (0.54) KEAP1SMN1; SMN2GNAI3GNAO1GNAI1

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-20210322575-A1 LIPID NANOPARTICLE FORMULATIONS COMPRISING LIPIDATED CATIONIC PEPTIDE COMPOUNDS FOR NUCLEIC ACID DELIVERY NUTCRACKER THERAPEUTICS, INC. (US) 2021-10-21 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-20210322575-A1 LIPID NANOPARTICLE FORMULATIONS COMPRISING LIPIDATED CATIONIC PEPTIDE COMPOUNDS FOR NUCLEIC ACID DELIVERY PHOSPHO1, PLIN3, CETP KEAP1 2353/4885SMN1; SMN2 2989/4885GNAI3 2260/4885

“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.