SCHEMBL1225540

SCHEMBL1225540

O=C(O)c1c[nH]cc1C(=O)N1CCOCC1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.61
GAA P10253 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MYC P01106 1/20 0.49
TSHR P16473 3/20 0.49
MAPT P10636 1/20 0.49
HSP90AA1 P07900 1/20 0.47
KDM4E B2RXH2 1/20 0.47
HPGD P15428 2/20 0.47
ALDH1A1 P00352 3/20 0.47
KMT2A Q03164 1/20 0.46

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
SCHEMBL259211 0.80 ALDH1A1 (0.50) HTTGAATSHRMAPTKDM4E
SCHEMBL20267430 0.79 GAA (0.73) HTTGAASMN1; SMN2TSHRHPGD
SCHEMBL11937463 0.77 CNR1 (0.49) HTTGAASMN1; SMN2TSHRMAPT
SCHEMBL8727474 0.73 TSHR (0.69) HTTGAASMN1; SMN2TSHRALDH1A1
SCHEMBL7121916 0.73 SMN1; SMN2 (0.77) HTTGAASMN1; SMN2TSHRHPGD
SCHEMBL28144057 0.72 GAA (0.56) HTTGAASMN1; SMN2TSHRKDM4E
SCHEMBL1458472 0.71 HTT (0.52) HTTSMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL70047 0.71 NOTUM (0.65) GAASMN1; SMN2TSHRMAPTKDM4E
SCHEMBL28133023 0.70 HRH3 (0.55) GAAMYCKDM4EHPGDALDH1A1
SCHEMBL4696938 0.70 HPGD (0.72) HTTSMN1; SMN2TSHRMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2281822-B1 New dihydroindolone derivatives, method of preparing same and pharmaceutical compositions containing them SERVIER LAB (FR) 2013-01-16 EP disclosed
EP-2281822-A1 New dihydroindolone derivatives, method of preparing same and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2011-02-09 EP disclosed