SCHEMBL23978233

SCHEMBL23978233

O=C(O)c1ccc([N+](=O)[O-])c(COc2ccc(Cl)cc2)c1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.62
NR4A2 P43354 5/20 0.56
MRGPRX4 Q96LA9 1/20 0.53
MAOB P27338 1/20 0.53
BCL2 P10415 2/20 0.52
CASP6 P55212 1/20 0.50
KMT2A Q03164 4/20 0.49
ATM Q13315 1/20 0.49
MAPT P10636 1/20 0.48
PLA2G4B P0C869 1/20 0.48
MEN1 O00255 3/20 0.47
ALDH1A1 P00352 2/20 0.47
GAA P10253 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NR4A1 P22736 1/20 0.47
NR4A3 Q92570 1/20 0.47

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
SCHEMBL23978010 0.90 NR4A2 (0.60) POLBNR4A2MRGPRX4MAOBCASP6
SCHEMBL23978042 0.88 MAOB (0.60) POLBNR4A2MAOBBCL2CASP6
SCHEMBL1138750 0.81 MAOB (0.53) POLBNR4A2MAOBKMT2AMAPT
SCHEMBL23978033 0.80 MRGPRX4 (0.69) POLBNR4A2MRGPRX4MAOBKMT2A
SCHEMBL4299408 0.78 CASP6 (0.58) POLBCASP6KMT2AMAPTMEN1
SCHEMBL29897189 0.78 CASP6 (0.58) POLBCASP6KMT2AMAPTMEN1
SCHEMBL23978245 0.77 MAOB (0.60) NR4A2MAOBBCL2CASP6MAPT
SCHEMBL4253888 0.77 POLB (1.00) POLBCASP6KMT2AATMMAPT
SCHEMBL23978217 0.77 MRGPRX4 (0.60) POLBNR4A2MRGPRX4MAOBKMT2A
SCHEMBL28376698 0.76 MAOB (0.66) MAOBKMT2AATMMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210346405-A1 BCL-2 INHIBITORS AND THEIR USE AS PHARMACEUTICALS PRELUDE THERAPEUTICS INCORPORATED 2021-11-11 US disclosed
WO-2021222174-A1 BCL-2 INHIBITORS AND THEIR USE AS PHARMACEUTICALS PRELUDE THERAPEUTICS INCORPORATED (US) 2021-11-04 WO 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-20210346405-A1 BCL-2 INHIBITORS AND THEIR USE AS PHARMACEUTICALS BCL2, BCL2L2, BCL2L1 POLB 1240/4885NR4A2 3359/4885MRGPRX4 4677/4885

“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.