SCHEMBL2839532

SCHEMBL2839532

C[C@H](N)C(O)c1nc2ccccc2s1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.64
HPGD P15428 2/20 0.57
HIF1A Q16665 2/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
HSD17B10 Q99714 1/20 0.56
ALOX5 P09917 1/20 0.55
TSHR P16473 2/20 0.51
GAA P10253 2/20 0.51
MAPK1 P28482 1/20 0.51
CASR P41180 1/20 0.48
RAB9A P51151 4/20 0.47
APEX1 P27695 1/20 0.46
ALOX15 P16050 1/20 0.44
CASP1 P29466 1/20 0.44
MAPT P10636 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 2/20 0.43
ADRA2A P08913 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
SCHEMBL6651861 0.84 LOXL2 (0.60) LOXL2HPGDHIF1ACYP1A2CYP2C9
SCHEMBL6651670 0.84 LOXL2 (0.60) LOXL2HPGDHIF1ACYP1A2CYP2C9
SCHEMBL6651863 0.84 LOXL2 (0.60) LOXL2HPGDHIF1ACYP1A2CYP2C9
SCHEMBL7363930 0.83 LOXL2 (0.60) LOXL2HPGDHIF1ACYP1A2CYP2C9
SCHEMBL5968633 0.82 LOXL2 (0.67) LOXL2HPGDHIF1ACYP1A2CYP2C9
SCHEMBL485998 0.82 HPGD (0.64) LOXL2HPGDHIF1ACYP1A2CYP2C9
SCHEMBL5968556 0.82 LOXL2 (0.67) LOXL2HPGDHIF1ACYP1A2CYP2C9
SCHEMBL12085830 0.82 HPGD (0.64) LOXL2HPGDHIF1ACYP1A2CYP2C9
SCHEMBL17947424 0.82 HPGD (0.64) LOXL2HPGDHIF1ACYP1A2CYP2C9
SCHEMBL5968526 0.82 LOXL2 (0.67) LOXL2HPGDHIF1ACYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100099721-A1 NOVEL COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS PROBIODRUG AG (DE) 2010-04-22 US disclosed
US-7667044-B2 treating nervous system diorders such as Alzheimer's disease, Down Syndrome, Parkinson disease and Huntington chorea by administering inhibitors of prolyl endopeptidases PROBIODRUG AG (DE) 2010-02-23 US disclosed
EP-1824846-A2 NOVEL COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS Probiodrug AG (DE) 2007-08-29 EP disclosed
WO-2006058720-A2 NOVEL COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS PROBIODRUG AG (DE) 2006-06-08 WO disclosed
US-20060100253-A1 Novel compounds for the treatment of neurological disorders PROBIODRUG AG 2006-05-11 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 (2 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-20100099721-A1 NOVEL COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS PREP, BACE1, BCHE LOXL2 2191/4885HPGD 672/4885HIF1A 1769/4885
US-20060100253-A1 Novel compounds for the treatment of neurological disorders PREP, BACE1, BCHE LOXL2 2557/4885HPGD 794/4885HIF1A 1944/4885

“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.