SCHEMBL7367069

SCHEMBL7367069

CN(C)C(=O)C1CC(O)CN1C(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.60
HTR2C P28335 1/20 0.44
CYP3A4 P08684 2/20 0.44
TSHR P16473 1/20 0.44
PSEN1 P49768 1/20 0.43
PSEN2 P49810 1/20 0.43
APH1B Q8WW43 1/20 0.43
NCSTN Q92542 1/20 0.43
APH1A Q96BI3 1/20 0.43
PSENEN Q9NZ42 1/20 0.43
PREP P48147 3/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PDK1 Q15118 1/20 0.42
PDK2 Q15119 1/20 0.42
PDK3 Q15120 1/20 0.42
PDK4 Q16654 1/20 0.42
PARP1 P09874 1/20 0.41
TMEM97 Q5BJF2 1/20 0.41

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
SCHEMBL5356741 1.00 POLB (0.60) POLBHTR2CCYP3A4TSHRPSEN1
SCHEMBL7167268 1.00 POLB (0.60) POLBHTR2CCYP3A4TSHRPSEN1
SCHEMBL19131797 0.86 POLB (0.63) POLBHTR2CPSEN1PSEN2APH1B
SCHEMBL13259972 0.86 POLB (0.63) POLBHTR2CPSEN1PSEN2APH1B
SCHEMBL15760368 0.86 POLB (0.63) POLBHTR2CPSEN1PSEN2APH1B
SCHEMBL71528 0.86 POLB (0.62) POLBHTR2CPSEN1PSEN2APH1B
SCHEMBL71529 0.86 POLB (0.62) POLBHTR2CPSEN1PSEN2APH1B
SCHEMBL29878 0.86 POLB (0.62) POLBHTR2CPSEN1PSEN2APH1B
SCHEMBL7489292 0.86 POLB (0.62) POLBHTR2CPSEN1PSEN2APH1B
SCHEMBL7016734 0.86 POLB (0.62) POLBHTR2CPSEN1PSEN2APH1B

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-1255751-A2 1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES AND THEIR USE AS LIGANDS FOR V1B OR V1B AND V1A ARGININE-VASOPRESSIN RECEPTORS SANOFI-SYNTHELABO (FR) 2002-11-13 EP disclosed
WO-2001055130-A2 NOVEL 1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES AND THEIR USE AS LIGANDS FOR V1B AND V1A ARGININE-VASOPRESSIN RECEPTORS SANOFI-SYNTHELABO (FR) 2001-08-02 WO disclosed
EP-0243686-A2 Beta-lactam compounds, and their production SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1987-11-04 EP disclosed