SCHEMBL29324892

SCHEMBL29324892

CCOCCN1CCN(CC23CCCC(CC(C)C2)C3)CC1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL19173447 0.80 KDM4E (0.47) CYP2D6CYP2C19LMNARAB9AKDM4E
SCHEMBL24352138 0.78 KDM4E (0.54) CYP2D6LMNAKDM4E
SCHEMBL19235627 0.72 ACHE (0.37)
SCHEMBL22079811 0.72 GBA2 (0.34) LMNARAB9A
SCHEMBL22007041 0.72 GBA2 (0.34) LMNARAB9A
SCHEMBL16470994 0.69 GBA2 (0.32)
SCHEMBL21256228 0.68 LMNA (0.32) LMNARAB9A
SCHEMBL830929 0.68 CYP2D6 (0.49) CYP2D6CYP2C19LMNAKDM4E
SCHEMBL21256278 0.68
SCHEMBL21169292 0.68

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-20240238265-A1 ADAMANTANE AMIDES AND THIOAMIDES FOR THE TREATMENT OF EBOLAVIRUS INFECTION ARISAN THERAPEUTICS INC. (US) 2024-07-18 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-20240238265-A1 ADAMANTANE AMIDES AND THIOAMIDES FOR THE TREATMENT OF EBOLAVIRUS INFECTION IFNAR1, NR4A3, NR0B2 CYP2D6 2836/4885CYP2C19 4482/4885LMNA 3555/4885

“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.