SCHEMBL10101657

SCHEMBL10101657

[C-]#[N+]c1c(C(C)(C)C)n[nH]c1/N=N/c1c(O)n(-c2ccccc2)n(-c2ccccc2)c1=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.38
ALDH1A1 P00352 7/20 0.36
KDM4E B2RXH2 5/20 0.36
GAA P10253 5/20 0.36
TP53 P04637 1/20 0.35
MDM2 Q00987 1/20 0.35
L3MBTL1 Q9Y468 6/20 0.34
LMNA P02545 5/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
HPGD P15428 3/20 0.33
KMT2A Q03164 3/20 0.33
POLB P06746 2/20 0.33
TDP1 Q9NUW8 3/20 0.33
CCR6 P51684 1/20 0.31
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL12354947 0.84 MAPT (0.39) MAPTALDH1A1KDM4EGAAL3MBTL1
SCHEMBL10101677 0.84 TP53 (0.38) MAPTALDH1A1KDM4EGAATP53
SCHEMBL12354942 0.83 MAPT (0.33) MAPTALDH1A1KDM4EGAAL3MBTL1
SCHEMBL10106251 0.82 MAPT (0.38) MAPTALDH1A1KDM4EGAATP53
SCHEMBL13997022 0.82 MAPT (0.38) MAPTALDH1A1KDM4EGAATP53
SCHEMBL12354932 0.81 ATM (0.32) MAPTALDH1A1GAALMNAHPGD
SCHEMBL10101662 0.80 MAPT (0.37) MAPTALDH1A1KDM4EGAAL3MBTL1
SCHEMBL12439930 0.79 ALDH1A1 (0.34) MAPTALDH1A1KDM4EGAALMNA
SCHEMBL12354948 0.79 RIPK1 (0.32) MAPTALDH1A1GAALMNAHPGD
SCHEMBL12354960 0.78 CA1 (0.35) MAPTGAALMNAHPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8808824-B2 Optical information recording medium, method of recording information and azo metal complex dye FUJIFILM CORPORATION (JP) 2014-08-19 US disclosed
US-8092890-B2 Optical information recording medium, method of recording information, and azo metal complex dye FUJIFILM CORPORATION (JP) 2012-01-10 US disclosed
US-20110202942-A1 OPTICAL INFORMATION RECORDING MEDIUM, METHOD OF RECORDING INFORMATION AND PHOTOSENSITIZER FUJIFILM CORPORATION (JP) 2011-08-18 US disclosed
US-20110177281-A1 OPTICAL INFORMATION RECORDING MEDIUM, METHOD OF RECORDING INFORMATION AND AZO METAL COMPLEX DYE FUJIFILM CORPORATION (JP) 2011-07-21 US disclosed
US-20080254252-A1 OPTICAL INFORMATION RECORDING MEDIUM, METHOD OF RECORDING INFORMATION, AND AZO METAL COMPLEX DYE FUJIFILM CORPORATION (JP) 2008-10-16 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-20110202942-A1 OPTICAL INFORMATION RECORDING MEDIUM, METHOD OF RECORDING INFORMATION AND PHOTOSENSITIZER KCNN4, IK, KCNJ2 MAPT 977/4885ALDH1A1 1825/4885KDM4E 2051/4885

“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.