SCHEMBL24636199

SCHEMBL24636199

CC(O)C(NCC1(C(=O)O)CCCN1)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.39
ARG2 P78540 1/20 0.39
CYP2D6 P10635 2/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 2/20 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
SCHEMBL24636213 1.00 ARG1 (0.39) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL24636215 1.00 ARG1 (0.39) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL24636252 1.00 ARG1 (0.39) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL24636214 0.77
SCHEMBL17469315 0.71 SLC6A2 (0.43) CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL23128322 0.71 SLC6A2 (0.43) CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL30085352 0.67 ARG1 (0.53) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL1359692 0.67 ARG1 (0.53) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL1359695 0.67 ARG1 (0.53) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL28174553 0.67 ARG1 (0.53) ARG1ARG2CYP2D6SLC6A2SLC6A4

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-20220259217-A1 PROCESSES AND INTERMEDIATES FOR PRODUCING DIAZASPIRO LACTAM COMPOUNDS INNOVIVA TRC HOLDINGS LLC 2022-08-18 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-20220259217-A1 PROCESSES AND INTERMEDIATES FOR PRODUCING DIAZASPIRO LACTAM COMPOUNDS DDO, DHPS, PGLS ARG1 2789/4885ARG2 3161/4885CYP2D6 377/4885

“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.