SCHEMBL6423786

SCHEMBL6423786

O=C(CC(c1ccccc1)c1ccccc1)N1CCc2[nH]cnc2C1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CACNA2D1 P54289 8/20 0.47
CACNA1B Q00975 8/20 0.47
CACNB1 Q02641 8/20 0.47
CACNA1C Q13936 6/20 0.47
CACNA1H O95180 1/20 0.47
CNR1 P21554 1/20 0.45
SRD5A2 P31213 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
CACNA1G O43497 2/20 0.42
HPGD P15428 1/20 0.41

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
SCHEMBL22916009 0.82 NPC1 (0.47)
SCHEMBL15490068 0.82 POLB (0.37)
SCHEMBL22915949 0.81 NPC1 (0.51) TDP1HPGD
SCHEMBL22915890 0.78 KDM4E (0.47) HPGD
SCHEMBL15492450 0.78 CREBBP (0.47)
SCHEMBL4154205 0.78 ENPP2 (0.36)
SCHEMBL1994788 0.77 NAMPT (0.38)
SCHEMBL6421007 0.77 TRPV1 (0.52) HPGD
Oxalic Acid SCHEMBL6423517 0.76 GRIN2B (0.44)
Oxalic Acid SCHEMBL6419287 0.75 GAA (0.40)

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