SCHEMBL10144749

SCHEMBL10144749

CC1=C(C(=O)OCC2CCCO2)C(c2cccc(Cl)c2)NC(=O)N1

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.81
NPSR1 Q6W5P4 1/20 0.81
L3MBTL1 Q9Y468 1/20 0.78
GAA P10253 3/20 0.71
MAPK1 P28482 2/20 0.71
KMT2A Q03164 3/20 0.69
MEN1 O00255 2/20 0.69
LMNA P02545 1/20 0.67
POLB P06746 1/20 0.56
PDE1C Q14123 2/20 0.55
HTT P42858 1/20 0.55
KIF11 P52732 1/20 0.54
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
ADORA2B P29275 1/20 0.51

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
SCHEMBL6959316 0.83 POLB (0.80) SMN1; SMN2NPSR1L3MBTL1GAAMAPK1
SCHEMBL5351765 0.83 KIF11 (0.77) GAAMAPK1POLBHTTKIF11
SCHEMBL5339172 0.80 KIF11 (0.65) GAAMAPK1POLBHTTKIF11
SCHEMBL5345378 0.79 MAPT (0.66) GAAMAPK1POLBHTTKIF11
SCHEMBL3395556 0.79 SMN1; SMN2 (0.80) SMN1; SMN2NPSR1L3MBTL1GAAMAPK1
SCHEMBL13425955 0.79 SMN1; SMN2 (0.80) SMN1; SMN2NPSR1L3MBTL1GAAMAPK1
SCHEMBL3395549 0.79 SMN1; SMN2 (0.80) SMN1; SMN2NPSR1L3MBTL1GAAMAPK1
SCHEMBL3322690 0.79 KDM4E (0.81) NPSR1L3MBTL1GAALMNAPOLB
SCHEMBL6340753 0.78 PKM (0.77) GAAKIF11KDM4EALDH1A1ADORA2B
SCHEMBL10113219 0.77 ALDH1A1 (0.78) L3MBTL1GAAMAPK1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS BIOMARIN PHARMACEUTICAL INC. 2012-04-26 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-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS ENGASE, GALNT1, GALNT13 SMN1; SMN2 4780/4885NPSR1 2181/4885L3MBTL1 1767/4885

“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.