SCHEMBL1722710

SCHEMBL1722710

O=C(O)NNC(=O)CNC(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.60
LMNA P02545 2/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
MAPK1 P28482 1/20 0.57
PRSS1 P07477 2/20 0.56
TPSAB1 Q15661 2/20 0.56
TPSD1 Q9BZJ3 1/20 0.56
TPSG1 Q9NRR2 1/20 0.56
HTT P42858 2/20 0.55
CTSL P07711 1/20 0.52
CTSB P07858 1/20 0.52
CTSS P25774 1/20 0.52
CTSK P43235 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
KDM1A O60341 1/20 0.52
RCOR1 Q9UKL0 1/20 0.52
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PLAU P00749 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
SCHEMBL8149664 0.87 PRSS1 (0.73) ALDH1A1LMNASMN1; SMN2MAPK1PRSS1
SCHEMBL30576720 0.86 PRSS1 (0.71) ALDH1A1LMNASMN1; SMN2MAPK1PRSS1
SCHEMBL31550495 0.85 ALDH1A1 (0.62) ALDH1A1LMNASMN1; SMN2MAPK1PRSS1
SCHEMBL13073338 0.84 LMNA (0.59) ALDH1A1LMNASMN1; SMN2MAPK1PRSS1
SCHEMBL30440860 0.84 ALDH1A1 (0.60) ALDH1A1LMNASMN1; SMN2MAPK1PRSS1
SCHEMBL8426731 0.84 ALDH1A1 (0.60) ALDH1A1LMNASMN1; SMN2MAPK1PRSS1
SCHEMBL8178335 0.84 ALDH1A1 (0.60) ALDH1A1LMNASMN1; SMN2MAPK1PRSS1
SCHEMBL8323868 0.84 ALDH1A1 (0.60) ALDH1A1LMNASMN1; SMN2MAPK1PRSS1
SCHEMBL504661 0.84 ALDH1A1 (0.60) ALDH1A1LMNASMN1; SMN2MAPK1PRSS1
SCHEMBL5873775 0.84 ALDH1A1 (0.60) ALDH1A1LMNASMN1; SMN2MAPK1PRSS1

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
EP-4204393-A1 AMINOCARBAMOYL COMPOUNDS FOR THE TREATMENT OF VIRAL INFECTIONS F. Hoffmann-La Roche AG (CH) 2023-07-05 EP disclosed
EP-2403835-A1 NOVEL PHENYL IMIDAZOLES AND PHENYL TRIAZOLES AS GAMMA-SECRETASE MODULATORS Pfizer Inc. (US) 2012-01-11 EP disclosed
WO-2010100606-A1 NOVEL PHENYL IMIDAZOLES AND PHENYL TRIAZOLES AS GAMMA-SECRETASE MODULATORS PFIZER INC. (US) 2010-09-10 WO disclosed