SCHEMBL10045787

SCHEMBL10045787

COC(=O)C(NC(=O)OC(C)(C)C)c1nc(-c2nc(-c3nc(C(=O)OCc4ccccc4)co3)co2)co1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
SYK P43405 1/20 0.39
PPARA Q07869 1/20 0.38
KLK5 Q9Y337 4/20 0.37
ATM Q13315 3/20 0.36
JAK2 O60674 1/20 0.36
CTSL P07711 1/20 0.36
KLK7 P49862 2/20 0.36
CTSS P25774 2/20 0.36
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.36
PKM P14618 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
HTT P42858 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
HSD17B10 Q99714 2/20 0.36
TP53 P04637 1/20 0.36
AGTR1 P30556 1/20 0.36
RAB9A P51151 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
SCHEMBL10045782 0.97 MAPT (0.41) MAPTSYKPPARAKLK5ATM
SCHEMBL10072672 0.95 MAPT (0.40) MAPTSYKPPARAKLK5ATM
SCHEMBL800428 0.90 ATM (0.46) MAPTSYKPPARAKLK5ATM
SCHEMBL10045779 0.85 C3AR1 (0.35) MAPTKLK5ATMCTSSTSHR
SCHEMBL10045786 0.82 DAGLA (0.37) MAPTATMALDH1A1LMNAPKM
SCHEMBL10045817 0.80 MAPT (0.59) MAPTSYKKLK5KLK7NPSR1
SCHEMBL800936 0.79 ATM (0.41) PPARAATMCTSLCTSSPKM
SCHEMBL800427 0.79 ATM (0.38) MAPTATMALDH1A1LMNATSHR
SCHEMBL10045825 0.78 MAPT (0.56) MAPTSYKKLK5KLK7NPSR1
SCHEMBL10045820 0.77 MAPT (0.61) MAPTSYKKLK5KLK7NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8518928-B2 Therapeutic compounds RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2013-08-27 US disclosed
US-8093235-B2 Macrocyclic compounds which stabilize G-Quadruplex DNA and RNA RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2012-01-10 US disclosed
US-20090156627-A1 THERAPEUTIC COMPOUNDS NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-06-18 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-20090156627-A1 THERAPEUTIC COMPOUNDS TOP2B, DDB1, RECQL MAPT 1974/4885SYK 4150/4885PPARA 2968/4885

“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.