SCHEMBL30933280

SCHEMBL30933280

CCN(CC)CCCN(Cc1cc2cc3c(cc2[nH]c1=O)OCO3)C(=S)NCCCN(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 3/20 1.00
NSD2 O96028 2/20 1.00
RCE1 Q9Y256 1/20 1.00
POLB P06746 1/20 0.87
KMT2A Q03164 4/20 0.79
MEN1 O00255 3/20 0.79
KDM4E B2RXH2 2/20 0.70
ALDH1A1 P00352 2/20 0.70
GAA P10253 2/20 0.70
GLA P06280 1/20 0.70
L3MBTL1 Q9Y468 1/20 0.68

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
SCHEMBL18282645 1.00 RAD52 (1.00) RAD52NSD2RCE1POLBKMT2A
SCHEMBL16491215 0.84 KMT2A (1.00) RAD52NSD2RCE1KMT2AMEN1
SCHEMBL16171086 0.80 NSD2 (0.79) RAD52NSD2RCE1POLBKMT2A
SCHEMBL5456271 0.80 POLB (0.77) RAD52NSD2RCE1POLBKMT2A
SCHEMBL5457696 0.79 RAD52 (0.65) RAD52NSD2RCE1POLBKMT2A
SCHEMBL4075245 0.76 POLB (0.63) RAD52NSD2RCE1POLBKMT2A
SCHEMBL4256228 0.73 POLB (0.69) RAD52NSD2RCE1POLBKMT2A
SCHEMBL26568771 0.70 ALDH1A1 (0.79) RAD52KMT2AMEN1KDM4EALDH1A1
SCHEMBL26116157 0.70 KDM4E (0.75) RAD52KMT2AMEN1KDM4EALDH1A1
SCHEMBL26568017 0.68 KDM4E (0.66) RAD52NSD2RCE1POLBKMT2A

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-20240199636-A1 Inhibitors of RAD52 Recombination Protein and Methods Using Same UNIV DREXEL (US) 2024-06-20 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-20240199636-A1 Inhibitors of RAD52 Recombination Protein and Methods Using Same RAD52, RAD50, MRE11 RAD52 1/4885NSD2 1340/4885RCE1 121/4885

“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.