SCHEMBL6419627

SCHEMBL6419627

Cc1ccc(COC(=O)C(=O)On2cnc3c2CCN(C(=O)O)C3)cc1C

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.35
PTGDR2 Q9Y5Y4 4/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
FAAH O00519 1/20 0.33
MAPT P10636 1/20 0.33
BCL9 O00512 1/20 0.33
CTNNB1 P35222 1/20 0.33
PDK2 Q15119 1/20 0.33
P2RX7 Q99572 1/20 0.32
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SCD O00767 1/20 0.32
GPR183 P32249 1/20 0.31

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
SCHEMBL6420512 0.88 GRIN2B (0.40) FAAHMAPT
SCHEMBL6419465 0.87 PDK2 (0.36) HRH3PTGDR2MAPTPDK2P2RX7
SCHEMBL6423885 0.86 PTGDR2 (0.37) PTGDR2FAAHPDK2P2RX7GPR183
SCHEMBL6421015 0.85 GRIN2B (0.38) MEN1KMT2APDK2NPC1RAB9A
SCHEMBL6419564 0.85 HRH3 (0.39) HRH3PTGDR2MEN1KMT2AFAAH
SCHEMBL6420101 0.84 KDM4E (0.38) MEN1KMT2AFAAHMAPTNPC1
SCHEMBL6422626 0.84 PTGDR2 (0.37) PTGDR2MEN1KMT2APDK2NPC1
SCHEMBL6420064 0.83 GRIN2B (0.38) PTGDR2MEN1KMT2AMAPTPDK2
SCHEMBL6423530 0.82 PTGDR2 (0.36) PTGDR2MEN1KMT2AMAPTPDK2
SCHEMBL6420086 0.79 KMT2A (0.35) PTGDR2MEN1KMT2AMAPTPDK2

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