SCHEMBL6848265

SCHEMBL6848265

CN(C)CCOCCN1CCN(C=O)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.35
USP2 O75604 1/20 0.34
HRH3 Q9Y5N1 2/20 0.33
KDM2B Q8NHM5 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
BDKRB1 P46663 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 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
SCHEMBL6762044 0.84 ALOX15 (0.41) HSD17B10KDM4EALDH1A1BDKRB1MAPT
SCHEMBL3813922 0.83 HSD17B10 (0.40) HSD17B10HRH3KDM4EALDH1A1BDKRB1
SCHEMBL9534288 0.80 HSD17B10 (0.38) HSD17B10HRH3KDM4EALDH1A1TDP1
SCHEMBL31249899 0.80 HRH3 (0.47) HRH3KDM4EALDH1A1
SCHEMBL28734482 0.79 HSD17B10 (0.37) HSD17B10KDM4EALDH1A1TDP1MEN1
SCHEMBL9705235 0.78 HRH3 (0.50) HRH3KDM4EALDH1A1
SCHEMBL6848264 0.78 HRH3 (0.33) USP2HRH3KDM2BKDM4EALDH1A1
SCHEMBL7767622 0.77 HTR1A (0.45) HSD17B10USP2KDM4EALDH1A1MEN1
SCHEMBL28686662 0.76 CARM1 (0.38) HSD17B10HRH3KDM4EALDH1A1
SCHEMBL1783126 0.76 HSD11B1 (0.41) HSD17B10KDM4EALDH1A1TDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0799827-B1 ACRYLAMIDE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME KYORIN SEIYAKU KK (JP) 2004-05-12 EP claimed
EP-0799827-B1 ACRYLAMIDE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME KYORIN SEIYAKU KK (JP) 2004-05-12 EP disclosed
EP-0656360-B1 TRIFLUOROMETHYLPYRROLOINDOLE CARBOXYLIC ESTER DERIVATIVE AND PROCESS FOR PRODUCING THE SAME KYORIN SEIYAKU KK (JP) 2002-11-20 EP disclosed
EP-0799827-A1 ACRYLAMIDE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME KYORIN PHARMACEUTICAL CO., LTD. (JP) 1997-10-08 EP disclosed
US-5629430-A ANTICARCINOGENIC AGENTS KYORIN PHARMACEUTICAL CO., LTD. (JP) 1997-05-13 US disclosed
EP-0656360-A1 TRIFLUOROMETHYLPYRROLOINDOLE CARBOXYLIC ESTER DERIVATIVE AND PROCESS FOR PRODUCING THE SAME KYORIN PHARMACEUTICAL CO., LTD. (JP) 1995-06-07 EP disclosed