SCHEMBL13650091

SCHEMBL13650091

O=C(CN(CCCCOCCCCN(CC(=O)N/N=C/c1cc(Br)c(O)c(Br)c1)c1cccc2ccccc12)c1cccc2ccccc12)N/N=C/c1cc(Br)c(O)c(Br)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BLM P54132 1/20 0.47
▸ MEN1 O00255 9/20 0.42
▸ KMT2A Q03164 9/20 0.42
▸ POLB P06746 5/20 0.42
▸ CHEK1 O14757 1/20 0.41
▸ AURKA O14965 1/20 0.41
▸ DAPK3 O43293 1/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ PRKD3 O94806 1/20 0.41
▸ MAP4K4 O95819 1/20 0.41
▸ PAK4 O96013 1/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ NTRK1 P04629 1/20 0.41
▸ LCK P06239 1/20 0.41
▸ CSF1R P07333 1/20 0.41
▸ RET P07949 1/20 0.41
▸ IGF1R P08069 1/20 0.41
▸ MET P08581 1/20 0.41
▸ PDGFRB P09619 1/20 0.41
▸ PIM1 P11309 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
SCHEMBL13650105 0.92 BLM (0.41) BLMMEN1KMT2APOLBMAPT
SCHEMBL13650083 0.90 CFTR (0.49) MEN1KMT2APOLBHIF1ANPC1
SCHEMBL13650086 0.85 MEN1 (0.45) BLMMEN1KMT2APOLBCHEK1
SCHEMBL13650099 0.84 MEN1 (0.44) BLMMEN1KMT2APOLBCHEK1
SCHEMBL13650106 0.77 SIRT1 (0.49) MEN1KMT2APOLBMAPTLMNA
SCHEMBL13650092 0.77 SIRT1 (0.48) MEN1KMT2APOLBMAPTLMNA
SCHEMBL13650095 0.76 MEN1 (0.43) MEN1KMT2APOLBCHEK1AURKA
SCHEMBL13650085 0.74 CFTR (0.56) MEN1KMT2APOLBNPC1
SCHEMBL12648526 0.74 MAPT (0.66) BLMMEN1KMT2APOLBCHEK1
SCHEMBL13650098 0.74 CFTR (0.53) MEN1KMT2APOLBNPC1

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-20090253799-A1 DIVALENT HYDRAZIDE COMPOUND CONJUGATES FOR INHIBITING CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-10-08 — — 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-20090253799-A1 DIVALENT HYDRAZIDE COMPOUND CONJUGATES FOR INHIBITING CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SLC26A4, SLC26A3 BLM 1540/4885MEN1 4189/4885KMT2A 3845/4885

“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.

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