SCHEMBL1577573

SCHEMBL1577573

CCOC(=O)Oc1nnc(C)c(C)n1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
SOAT1 P35610 1/20 0.40
ALOX5 P09917 1/20 0.40
TSHR P16473 1/20 0.35
LMNA P02545 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.34
HPGD P15428 1/20 0.34
MAPT P10636 1/20 0.34
PDE4D Q08499 1/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CA2 P00918 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.32
CDC7 O00311 1/20 0.32
DBF4 Q9UBU7 1/20 0.32

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
SCHEMBL1542120 0.76 ALDH1A1 (0.39) ALDH1A1LMNAKDM4E
SCHEMBL4049854 0.75 KDM4E (0.40) ALDH1A1SOAT1ALOX5KDM4ECYP1A2
SCHEMBL1542290 0.75 KDM4E (0.39) ALDH1A1SOAT1KDM4ECYP1A2MAPT
SCHEMBL7013807 0.75 ALDH1A1 (0.48) ALDH1A1SOAT1ALOX5LMNAKDM4E
SCHEMBL9407460 0.75 ALDH1A1 (0.38) ALDH1A1LMNAKDM4E
SCHEMBL10511469 0.69 ALDH1A1 (0.46) ALDH1A1SOAT1ALOX5TSHRLMNA
SCHEMBL638409 0.69 CYP1A2 (0.44) ALDH1A1TSHRLMNAKDM4ECYP1A2
SCHEMBL10803650 0.69 ALDH1A1 (0.38) ALDH1A1SOAT1ALOX5TSHRKDM4E
SCHEMBL8724571 0.68 CYP1A2 (0.46) ALDH1A1LMNAKDM4ECYP1A2MAPT
SCHEMBL4070899 0.68 ALDH1A1 (0.40) ALDH1A1SOAT1ALOX5LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3424926-A1 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINS, THEIR PRODUCTION AND UTILISATION AS MEDICINE Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2019-01-09 EP disclosed
EP-1532149-B9 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THE PRODUCTION THEREOF AND THE USE OF THE SAME AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA (DE) 2011-04-20 EP disclosed
EP-1532149-B1 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THE PRODUCTION THEREOF AND THE USE OF THE SAME AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA (DE) 2009-12-30 EP disclosed
EP-2070539-A1 8-[3-amino-piperidin-1-yl]-xanthins, their production and utilisation as medicine Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2009-06-17 EP disclosed
EP-2060573-A2 8-[3-amino-piperidin-1-yl]-xanthins, their production and utilisation as medicine Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2009-05-20 EP disclosed
EP-2058311-A2 8-[3-amino-piperidin-1-yl]-xanthins, their production and utilisation as medicine Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2009-05-13 EP disclosed
EP-1532149-A2 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THE PRODUCTION THEREOF AND THE USE OF THE SAME AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-05-25 EP disclosed
WO-2004018468-A2 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THE PRODUCTION THEREOF AND THE USE OF THE SAME AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-03-04 WO disclosed
EP-0591767-A1 Sulfonylated triazine carboxamides BAYER AG (DE) 1994-04-13 EP disclosed