SCHEMBL6422949

SCHEMBL6422949

O=C(CC1CC2CCC1C2)N1CCc2[nH]cnc2C1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
ALDH1A1 P00352 3/20 0.53
KDM4E B2RXH2 2/20 0.53
TP53 P04637 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HSD17B10 Q99714 1/20 0.53
P2RX7 Q99572 1/20 0.37
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
HPGD P15428 2/20 0.33
MAPT P10636 2/20 0.33
HTT P42858 2/20 0.33
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
ENPP2 Q13822 1/20 0.33
SIRT5 Q9NXA8 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA1 P30542 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
SCHEMBL4154205 0.74 ENPP2 (0.36) KDM4ERAB9ANPC1ENPP2
SCHEMBL15492450 0.74 CREBBP (0.47) KDM4ERAB9ANPC1ENPP2
SCHEMBL15490068 0.73 POLB (0.37) ALDH1A1NPSR1L3MBTL1KMT2AMEN1
SCHEMBL6851284 0.72 RAB9A (0.51) LMNAALDH1A1KDM4EP2RX7TDP1
SCHEMBL6419365 0.71 HSD11B1 (0.43) LMNAALDH1A1KDM4ETP53KMT2A
SCHEMBL6423555 0.71 HRH4 (0.39) KDM4EENPP2
SCHEMBL1994788 0.71 NAMPT (0.38) KDM4EENPP2
SCHEMBL9337878 0.70 ALDH1A1 (0.43) LMNAALDH1A1KDM4ETP53NPSR1
SCHEMBL31595886 0.70 NAMPT (0.37) KDM4EENPP2
SCHEMBL12662820 0.70 BAZ2B (0.43) LMNAMAPTENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6908926-B1 Substituted imidazoles, their preparation and use NOVO NORDISK A/S (DK) 2005-06-21 US disclosed
EP-1173438-A1 SUBSTITUTED IMIDAZOLES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2002-01-23 EP disclosed
WO-2000063208-A1 SUBSTITUTED IMIDAZOLES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-10-26 WO disclosed