SCHEMBL20552199

SCHEMBL20552199

Cc1nn(CCN(C)C)c(N)c1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
GAA P10253 2/20 0.38
KDM4E B2RXH2 3/20 0.35
HPGD P15428 2/20 0.33
ALDH1A1 P00352 2/20 0.33
P2RX7 Q99572 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NR3C1 P04150 1/20 0.32
KDM5A P29375 1/20 0.32
KDM5B Q9UGL1 1/20 0.32
MAPT P10636 1/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL20551643 0.82 MAPK1 (0.57) MAPK1KMT2AMEN1GAAKDM4E
SCHEMBL20551370 0.82 MAPK1 (0.46) POLBMAPK1KMT2AMEN1GAA
SCHEMBL20551500 0.80 KDM4E (0.36) POLBGAAKDM4EALDH1A1P2RX7
SCHEMBL19668771 0.78 MAPK1 (0.48) POLBMAPK1KMT2AMEN1GAA
SCHEMBL20550955 0.78 MAPK1 (0.43) POLBMAPK1KMT2AMEN1GAA
SCHEMBL20550959 0.76 MAPK1 (0.41) POLBMAPK1KMT2AMEN1GAA
SCHEMBL20552930 0.76 MEN1 (0.40) POLBMAPK1KMT2AMEN1GAA
SCHEMBL22286225 0.75 KMT2A (0.40) POLBMAPK1KMT2AMEN1GAA
SCHEMBL20551709 0.75 MEN1 (0.40) POLBMAPK1KMT2AMEN1GAA
SCHEMBL20551536 0.74 POLB (0.42) POLBMAPK1KMT2AMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200247800-A1 SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS NADPH OXIDASE INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2020-08-06 US disclosed
CN-110914263-A Substituted bicyclic heterocyclic compounds as NADPH oxidase inhibitors 格兰马克药品股份有限公司 2020-03-24 CN disclosed
EP-3619209-A1 SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS NADPH OXIDASE INHIBITORS Glenmark Pharmaceuticals S.A. (CH) 2020-03-11 EP disclosed
WO-2018203298-A1 SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS NADPH OXIDASE INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2018-11-08 WO 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-20200247800-A1 SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS NADPH OXIDASE INHIBITORS NOX1, CYBB, NOX4 POLB 560/4885MAPK1 943/4885KMT2A 3820/4885

“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.