SCHEMBL23373810

SCHEMBL23373810

CN(CCON)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.66
NPC1 O15118 1/20 0.66
POLB P06746 1/20 0.66
RAB9A P51151 1/20 0.66
KMT2A Q03164 1/20 0.66
SCP2 P22307 1/20 0.47
PTPRA P18433 1/20 0.43
PTPRB P23467 1/20 0.43
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
BRCA1 P38398 1/20 0.40
HIF1A Q16665 1/20 0.40
TNKS O95271 1/20 0.39
GPR84 Q9NQS5 10/20 0.38
SIGMAR1 Q99720 5/20 0.36

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
SCHEMBL62448 0.86 MEN1 (0.69) MEN1NPC1POLBRAB9AKMT2A
SCHEMBL62437 0.85 MEN1 (0.59) MEN1NPC1POLBRAB9AKMT2A
SCHEMBL13201657 0.84 MEN1 (0.58) MEN1NPC1POLBRAB9AKMT2A
SCHEMBL8858355 0.82 NPC1 (0.76) MEN1NPC1POLBRAB9AKMT2A
SCHEMBL13182571 0.80 MEN1 (0.60) MEN1NPC1POLBRAB9AKMT2A
Nile Red SCHEMBL49047 0.79 MEN1 (1.00) MEN1NPC1POLBRAB9AKMT2A
Nile Red SCHEMBL29373685 0.79 MEN1 (1.00) MEN1NPC1POLBRAB9AKMT2A
SCHEMBL23373808 0.77 RAB9A (0.56) MEN1NPC1POLBRAB9AKMT2A
SCHEMBL31722939 0.77 NPC1 (0.74) MEN1NPC1POLBRAB9AKMT2A
SCHEMBL14986327 0.77 NPC1 (0.74) MEN1NPC1POLBRAB9AKMT2A

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-20210147932-A1 FLUORESCENT PROBES FOR QUANTIFICATION OF DNA DAMAGE AND REPAIR THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2021-05-20 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-20210147932-A1 FLUORESCENT PROBES FOR QUANTIFICATION OF DNA DAMAGE AND REPAIR UNG, OGG1, FEN1 MEN1 4141/4885NPC1 2637/4885POLB 31/4885

“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.