SCHEMBL6419291

SCHEMBL6419291

O=C(O)CCN1c2ccccc2CCc2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.66
KMT2A Q03164 3/20 0.66
MAPT P10636 3/20 0.66
POLB P06746 2/20 0.66
KDM4E B2RXH2 2/20 0.66
TDP1 Q9NUW8 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.66
LMNA P02545 3/20 0.60
NOTUM Q6P988 1/20 0.55
MTNR1A P48039 1/20 0.55
MTNR1B P49286 1/20 0.55
HTR2A P28223 3/20 0.54
SLC6A2 P23975 3/20 0.50
SLC22A2 O15244 2/20 0.50
SLC22A1 O15245 2/20 0.50
SLC22A3 O75751 2/20 0.50
CHRM2 P08172 2/20 0.50
CYP2D6 P10635 2/20 0.50
CHRM1 P11229 2/20 0.50
DRD2 P14416 2/20 0.50

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
SCHEMBL18350824 0.91 MEN1 (0.62) MEN1KMT2AMAPTPOLBKDM4E
SCHEMBL3309754 0.90 POLB (0.60) MEN1KMT2AMAPTPOLBKDM4E
SCHEMBL30808659 0.90 POLB (0.60) MEN1KMT2AMAPTPOLBKDM4E
SCHEMBL8025555 0.90 HTR2A (0.60) MEN1KMT2AMAPTPOLBKDM4E
SCHEMBL18888413 0.85 MEN1 (0.72) MEN1KMT2AMAPTPOLBKDM4E
SCHEMBL7603769 0.82 SLC6A2 (0.58) MEN1KMT2AMAPTPOLBKDM4E
SCHEMBL15486077 0.81 KDM4E (0.55) MEN1KMT2AMAPTPOLBKDM4E
Hydrochloric Acid SCHEMBL7810034 0.81 SLC6A2 (0.59) MEN1KMT2AMAPTPOLBKDM4E
SCHEMBL4733904 0.81 SLC6A4 (0.65) MEN1KMT2AMAPTKDM4ETDP1
SCHEMBL18350826 0.81 MEN1 (0.51) MEN1KMT2AMAPTPOLBKDM4E

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
US-6908926-B1 Substituted imidazoles, their preparation and use NOVO NORDISK A/S (DK) 2005-06-21 US disclosed
US-6569849-B1 N-Substituted azaheterocyclic compounds NOVO NORDISK A/S (DK) 2003-05-27 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
EP-0934306-A1 N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1999-08-11 EP disclosed
WO-1998015546-A1 N-SUBSTITUTED AZAHETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1998-04-16 WO disclosed