SCHEMBL4693583

SCHEMBL4693583

O=C(NC1CCCCN1)c1ccoc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMIGD3 P0DMS9 1/20 0.40
ADORA1 P30542 1/20 0.40
PTPN1 P18031 1/20 0.38
PTPN6 P29350 1/20 0.38
PTPN11 Q06124 1/20 0.38
RAB9A P51151 6/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA7 P36544 1/20 0.37
CHRNA4 P43681 1/20 0.37
KCNK3 O14649 1/20 0.37
KCNK9 Q9NPC2 1/20 0.37
NPC1 O15118 4/20 0.35
ADORA2B P29275 1/20 0.34
MAPK14 Q16539 1/20 0.34
CTSS P25774 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL28564491 0.75 RAB9A (0.59) ADORA1RAB9ANPC1CYP1A2HPGD
SCHEMBL20810429 0.74 RAB9A (0.42) RAB9AKMT2ANPC1CYP1A2HPGD
SCHEMBL25143774 0.74 DDB1 (0.47) RAB9AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL28565006 0.71 RAB9A (0.56) RAB9AMEN1KMT2ANPC1CYP1A2
SCHEMBL27916661 0.70 ALDH1A1 (0.41) TMIGD3ADORA1PTPN1PTPN6PTPN11
SCHEMBL9472381 0.69 HPGD (0.62) RAB9AMEN1KMT2ANPC1CYP1A2
SCHEMBL27394121 0.69 NPC1 (0.55) RAB9AKMT2ANPC1SMN1; SMN2
SCHEMBL9194789 0.68 SCN9A (0.43) RAB9ANPC1CYP1A2HPGDCYP2C19
SCHEMBL11282807 0.67 SMN1; SMN2 (0.48) PTPN11RAB9AMEN1KMT2ANPC1
SCHEMBL28013415 0.67 MEN1 (0.36) MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1443046-B1 NOVEL 4-(2FUROYL)AMINOPIPERIDINES, INTERMEDIATES IN SYNTHESIZING THE SAME, PROCESS FOR PRODUCING THE SAME AND MEDICINAL USE OF THE SAME KYORIN SEIYAKU KK (JP) 2008-12-17 EP disclosed
CN-1326853-C 4- (2-furoyl) aminopiperidines, intermediates for the synthesis thereof, process for the preparation thereof and use thereof as medicaments KYORIN SEIYAKU KK (JP) 2007-07-18 CN disclosed
EP-1443046-A4 NOVEL 4-(2FUROYL)AMINOPIPERIDINES, INTERMEDIATES IN SYNTHESIZING THE SAME, PROCESS FOR PRODUCING THE SAME AND MEDICINAL USE OF THE SAME KYORIN SEIYAKU KK (JP) 2005-11-16 EP disclosed
CN-1582286-A Novel 4-2-furoylaminopiperidines, intermediates in synthesizing the same, process for producing the same and medicinal use of the same KYORIN SEIYAKU KK (JP) 2005-02-16 CN disclosed