SCHEMBL13151826

SCHEMBL13151826

COc1cc(/N=N/c2cccc(P(=O)(O)O)c2)ccc1Nc1nc(O)nc(Nc2ccc(/N=N/c3cccc(P(=O)(O)O)c3)cc2OC)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.39
▸ KMT2A Q03164 4/20 0.37
▸ LMNA P02545 1/20 0.37
▸ PTK2 Q05397 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ CCNT1 O60563 2/20 0.37
▸ CDK9 P50750 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ HSP90AA1 P07900 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ INSR P06213 4/20 0.36
▸ IGF1R P08069 4/20 0.36
▸ ALK Q9UM73 4/20 0.36
▸ MAPT P10636 3/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ LRRK2 Q5S007 2/20 0.35
▸ BRD4 O60885 1/20 0.34

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
SCHEMBL13151838 0.83 CCNT1 (0.40) GAAKMT2APTK2MEN1CCNT1
SCHEMBL13151899 0.79 ENPP2 (0.52) KMT2AMEN1ALDH1A1BRD4
SCHEMBL13151909 0.79 ENPP2 (0.49) KMT2AMEN1ALDH1A1
SCHEMBL13879847 0.78 ENPP2 (0.51) KMT2AMEN1RAB9AMAPTKDM4E
SCHEMBL13151812 0.77 MAPT (0.37) GAAKMT2ALMNAPTK2RAB9A
SCHEMBL13151907 0.76 PTGS2 (0.42) GAAKMT2ALMNAPTK2MEN1
SCHEMBL13911192 0.75 PHLPP2 (0.46) GAAKMT2APTK2MEN1L3MBTL1
SCHEMBL13911193 0.73 CHAT (0.40) GAAKMT2APTK2MEN1MAPT
SCHEMBL13151856 0.72 PHLPP2 (0.45) GAAKMT2AMEN1MAPTKDM4E
SCHEMBL13151900 0.72 SENP2 (0.40) GAAKMT2AMEN1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799122-B2 Azo compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-09-21 — — US disclosed
US-7799122-B2 Azo compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-09-21 — — US disclosed
US-20100151212-A1 Azo compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-06-17 — — US disclosed
US-20100151212-A1 Azo compounds FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-06-17 — — 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-20100151212-A1 Azo compounds PAH, CYP1A1, RB1 GAA 4440/4885KMT2A 392/4885LMNA 2554/4885

“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.

Send feedback