SCHEMBL4832410

SCHEMBL4832410

CCOC(=O)C1=NN(c2cccc3ccccc23)C(C(=O)OCC)=NN1c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
CDC25B P30305 3/20 0.46
ALOX15 P16050 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MAPK1 P28482 2/20 0.44
TP53 P04637 2/20 0.44
HCRTR1 O43613 1/20 0.44
RAB9A P51151 1/20 0.44
CDC25A P30304 1/20 0.43
CDC25C P30307 1/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
GABRA2 P47869 2/20 0.43
GABRB2 P47870 2/20 0.43
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL4835948 0.94 CDC25B (0.51) CDC25BALOX15KMT2AMEN1MAPT
SCHEMBL14269199 0.85 GAA (0.61) GAAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL4826745 0.78 MAPT (0.57) GAAKMT2AMEN1MAPTMAPK1
SCHEMBL4836070 0.74 LMNA (0.56) GAAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL4830389 0.72 KDM4E (0.63) CDC25BKMT2AMAPTSMN1; SMN2MAPK1
SCHEMBL4830399 0.71 GAA (0.48) GAAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL28216149 0.70 KMT2A (0.52) GAACDC25BKMT2AMEN1MAPT
SCHEMBL6312871 0.69 ALDH1A1 (0.56) CDC25BKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL3265630 0.68 MAPT (0.64) GAACDC25BALOX15KMT2AMEN1
SCHEMBL859755 0.68 CDC25B (0.52) CDC25BKMT2AMEN1MAPTSMN1; SMN2

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-7329651-B2 Cannabimimetic ligands UNIVERSITY OF CONNECTICUT (US) 2008-02-12 US disclosed
US-20040077649-A1 Novel cannabimimetic ligands CONNECTICUT, UNIVERSITY OF 2004-04-22 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-20040077649-A1 Novel cannabimimetic ligands CNR2, CNR1, GPR18 GAA 3345/4885CDC25B 3243/4885ALOX15 980/4885

“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.