SCHEMBL13664158

SCHEMBL13664158

CCOC(=O)/C(Br)=N/Nc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.62
LMNA P02545 3/20 0.62
ALDH1A1 P00352 4/20 0.60
NPSR1 Q6W5P4 3/20 0.60
HPGD P15428 2/20 0.60
ATM Q13315 1/20 0.60
MAPT P10636 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
TDP1 Q9NUW8 2/20 0.51
RECQL P46063 1/20 0.51
KYAT1 Q16773 6/20 0.50
DHODH Q02127 1/20 0.47
HTT P42858 1/20 0.46

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
SCHEMBL10479612 1.00 GAA (0.62) GAALMNAALDH1A1NPSR1HPGD
SCHEMBL10479609 1.00 GAA (0.62) GAALMNAALDH1A1NPSR1HPGD
SCHEMBL10479460 0.86 KYAT1 (0.62) GAALMNAALDH1A1NPSR1HPGD
SCHEMBL4104434 0.85 MEN1 (0.62) GAALMNAALDH1A1NPSR1HPGD
SCHEMBL10479779 0.85 MAPT (0.57) GAALMNAALDH1A1NPSR1HPGD
SCHEMBL13664219 0.85 MAPT (0.57) GAALMNAALDH1A1NPSR1HPGD
SCHEMBL10479594 0.85 MAPT (0.57) GAALMNAALDH1A1NPSR1HPGD
SCHEMBL13901610 0.84 GAA (0.62) GAALMNAALDH1A1NPSR1HPGD
SCHEMBL9881210 0.84 GAA (0.62) GAALMNAALDH1A1NPSR1HPGD
SCHEMBL13901608 0.83 GAA (0.63) GAALMNAALDH1A1NPSR1HPGD

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-20090253673-A1 Substituted Pyrazoles as Ghrelin Receptor Antagonists MERCK SHARP & DOHME CORP. 2009-10-08 US disclosed
US-20090253673-A1 Substituted Pyrazoles as Ghrelin Receptor Antagonists MERCK SHARP & DOHME CORP. 2009-10-08 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-20090253673-A1 Substituted Pyrazoles as Ghrelin Receptor Antagonists GIPR, GPR119, GLP1R GAA 2005/4885LMNA 4188/4885ALDH1A1 3415/4885

“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.