SCHEMBL12133348

SCHEMBL12133348

COc1cc(/N=N/c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)cc1/N=N/c1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.43
▸ KMT2A Q03164 6/20 0.43
▸ MAPT P10636 6/20 0.43
▸ ALDH1A1 P00352 5/20 0.43
▸ HTT P42858 3/20 0.43
▸ LMNA P02545 3/20 0.43
▸ POLB P06746 2/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ TDP1 Q9NUW8 2/20 0.39
▸ RAB9A P51151 1/20 0.38
▸ MPI P34949 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TTR P02766 2/20 0.38
▸ ACHE P22303 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 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
SCHEMBL13644731 0.95 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL24594401 0.92 ALDH1A1 (0.43) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL10079080 0.92 ALDH1A1 (0.43) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL12133421 0.91 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL19041078 0.86 ALDH1A1 (0.40) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL21339523 0.86 ALDH1A1 (0.40) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL10079082 0.86 ACHE (0.51) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL15433373 0.86 ACHE (0.51) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL13593603 0.85 ALDH1A1 (0.43) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL24594127 0.85 ALDH1A1 (0.43) MEN1KMT2AMAPTALDH1A1LMNA

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-8674094-B2 Stabilized nucleic acid dark quencher-fluorophore probes BIOSEARCH TECHNOLOGIES, INC. (US) 2014-03-18 — — US disclosed
US-20110282041-A1 STABILIZED NUCLEIC ACID DARK QUENCHER-FLUOROPHORE PROBES BIOSEARCH TECHNOLOGIES, INC. (US) 2011-11-17 — — 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-20110282041-A1 STABILIZED NUCLEIC ACID DARK QUENCHER-FLUOROPHORE PROBES DDX1, DDX18, DDX3X MEN1 3912/4885KMT2A 984/4885MAPT 2836/4885

“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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