SCHEMBL21273531

SCHEMBL21273531

O=C(O)NC(CO)C(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.47
ERCC5 P28715 1/20 0.46
FEN1 P39748 1/20 0.46
HAO1 Q9UJM8 1/20 0.46
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
SMN1; SMN2 Q16637 8/20 0.44
MAPT P10636 3/20 0.44
GSK3B P49841 3/20 0.44
ROCK2 O75116 2/20 0.44
RPS6KA5 O75582 2/20 0.44
PRKACA P17612 2/20 0.44
MAPK1 P28482 2/20 0.44
GSK3A P49840 2/20 0.44
IRAK1 P51617 2/20 0.44
PRKX P51817 2/20 0.44
ROCK1 Q13464 2/20 0.44
PRKG1 Q13976 2/20 0.44
PKN2 Q16513 2/20 0.44

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
SCHEMBL4177126 0.91 MDM2 (0.44) ERCC5FEN1RAB9ANPC1SMN1; SMN2
SCHEMBL3316473 0.91 MDM2 (0.44) ERCC5FEN1RAB9ANPC1SMN1; SMN2
SCHEMBL19661441 0.79 CTSK (0.54)
SCHEMBL3118546 0.77 CTSS (0.44) ALDH1A1
SCHEMBL12985717 0.76 CA2 (0.65) HPGDSRAB9ANPC1CTDSP1GSK3B
SCHEMBL10346696 0.76 CA2 (0.65) HPGDSRAB9ANPC1CTDSP1GSK3B
SCHEMBL2714974 0.75 MDM2 (0.43) RAB9ANPC1SMN1; SMN2MAPTMAPK1
SCHEMBL4332252 0.75 LMNA (0.47) RAB9ANPC1SMN1; SMN2MAPTMAPK1
SCHEMBL18803705 0.75 NPC1 (0.59) HPGDSRAB9ANPC1CTDSP1SMN1; SMN2
SCHEMBL28917674 0.73 MDM2 (0.44) ERCC5FEN1RAB9ANPC1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190256454-A1 NEW PROCESS FOR EARLY SACUBITRIL INTERMEDIATES NOVARTIS PHARMA AG (CH) 2019-08-22 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-20190256454-A1 NEW PROCESS FOR EARLY SACUBITRIL INTERMEDIATES MME, ACE, DNPEP HPGDS 4128/4885ERCC5 3387/4885FEN1 2938/4885

“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.