SCHEMBL6848264

SCHEMBL6848264

CN(C)CCOCCN1CCN([C]=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.33
KDM2B Q8NHM5 1/20 0.32
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
BDKRB1 P46663 2/20 0.31
ALOX15 P16050 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
USP2 O75604 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
RAB9A P51151 1/20 0.30
HTR1A P08908 1/20 0.30

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
SCHEMBL6762041 0.82 ALOX15 (0.44) HRH3ALDH1A1ALOX15CA1CA2
SCHEMBL6852451 0.82 PIM1 (0.35) ALOX15
SCHEMBL31249899 0.78 HRH3 (0.47) HRH3KDM4EALDH1A1
SCHEMBL6848265 0.78 HSD17B10 (0.35) HRH3KDM2BKDM4EALDH1A1BDKRB1
SCHEMBL5528947 0.77 HTR1A (0.44) KDM4EALDH1A1USP2HTR1A
SCHEMBL9705235 0.77 HRH3 (0.50) HRH3KDM4EALDH1A1
SCHEMBL1783124 0.74 HSD11B1 (0.41) KDM2BKDM4EALDH1A1TDP1
SCHEMBL1132784 0.74 TSHR (0.46) HRH3KDM4EALDH1A1USP2
SCHEMBL6042750 0.72 CYP2D6 (0.35) HRH3KDM4ETDP1RAB9A
SCHEMBL6043531 0.72 KDM4E (0.35) HRH3KDM4EALDH1A1TDP1

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