SCHEMBL6843536

SCHEMBL6843536

C1=C\c2ccccc2/N=N\c2ccccc2/1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
GAA P10253 1/20 0.39
TRPA1 O75762 3/20 0.36
LMNA P02545 3/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
BCHE P06276 1/20 0.33
POLB P06746 1/20 0.33
PTPRC P08575 1/20 0.33
THRB P10828 1/20 0.33
PKM P14618 1/20 0.33
IDO1 P14902 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
PTPN1 P18031 1/20 0.33
ACHE P22303 1/20 0.33
CES1 P23141 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL10434951 0.81 MAPT (0.39) MAPTGAATRPA1LMNAKDM4E
SCHEMBL612799 0.81 MAPT (0.39) MAPTGAATRPA1LMNAKDM4E
SCHEMBL5487950 0.75
SCHEMBL30373279 0.75
SCHEMBL10735763 0.75 TRPA1 (0.31) TRPA1
SCHEMBL10735757 0.75 TRPA1 (0.31) TRPA1
SCHEMBL8655845 0.73
SCHEMBL8655839 0.73
SCHEMBL9728983 0.73 TRPA1 (0.31) TRPA1
SCHEMBL4500203 0.73

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-20040248877-A1 Polycyclic diazodioxide-based Bcl-2 protein antagonists and use thereof RICERCA BIOSCIENCES, LLC. 2004-12-09 US disclosed
WO-2004099162-A1 POLYCYCLIC DIAZODIOXIDE-BASED BCL-2 PROTEIN ANTAGONIST RICERCA BIOSCIENCES, LLC. (US) 2004-11-18 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-20040248877-A1 Polycyclic diazodioxide-based Bcl-2 protein antagonists and use thereof BCL2L2, BCL2, BCL2L1 MAPT 4829/4885GAA 4474/4885TRPA1 4271/4885

“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.