SCHEMBL23440323

SCHEMBL23440323

NO[C@@H]1CN[C@@H](C(=O)O)C1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.52
CYP1A2 P05177 2/20 0.52
ALOX15 P16050 2/20 0.52
CYP2C19 P33261 2/20 0.52
SLC1A3 P43003 1/20 0.52
SLC1A2 P43004 1/20 0.52
SLC1A1 P43005 1/20 0.52
LMNA P02545 2/20 0.41
BLM P54132 2/20 0.41
TSHR P16473 1/20 0.41
RAB9A P51151 1/20 0.41
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
PMP22 Q01453 1/20 0.41
KMT2A Q03164 1/20 0.41
ARG1 P05089 1/20 0.41

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
SCHEMBL23440325 1.00 CYP2D6 (0.52) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3
SCHEMBL444056 1.00 CYP2D6 (0.52) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3
SCHEMBL23440285 1.00 CYP2D6 (0.52) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3
SCHEMBL444057 1.00 CYP2D6 (0.52) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3
SCHEMBL14532184 0.83 CYP2D6 (0.52) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3
SCHEMBL14561082 0.81 CYP2D6 (0.54) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3
SCHEMBL1513773 0.80 CYP2D6 (0.48) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3
SCHEMBL11386525 0.80 CYP2D6 (0.48) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3
SCHEMBL9358145 0.80 CYP2D6 (0.48) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3
SCHEMBL2266841 0.80 CYP2D6 (0.48) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230104758-A1 COMPOUNDS AND METHODS FOR AMINE OXIDASE IMAGING ETH ZURICH (CH) 2023-04-06 US disclosed
EP-4069684-A2 COMPOUNDS AND METHODS FOR AMINE OXIDASE IMAGING ETH Zurich (CH) 2022-10-12 EP disclosed
WO-2021110834-A2 COMPOUNDS AND METHODS FOR AMINE OXIDASE IMAGING ETH ZURICH (CH) 2021-06-10 WO disclosed
EP-3831820-A1 COMPOUNDS AND METHODS FOR AMINE OXIDASE IMAGING ETH Zurich (CH) 2021-06-09 EP 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-20230104758-A1 COMPOUNDS AND METHODS FOR AMINE OXIDASE IMAGING DAO, LOX, AOC2 CYP2D6 494/4885CYP1A2 179/4885ALOX15 434/4885

“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.