SCHEMBL7396015

SCHEMBL7396015

CN1C2CCCC1CC(N(C(N)=O)c1ccccc1-c1nc(C3CC3)no1)C2

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 4/20 0.37
FABP5 Q01469 4/20 0.37
POLB P06746 1/20 0.36
CASP3 P42574 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
HTR3A P46098 4/20 0.36
KCNH2 Q12809 2/20 0.36
CYP3A4 P08684 1/20 0.36
USP7 Q93009 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
SCN3A Q9NY46 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 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
SCHEMBL9363873 1.00 FABP4 (0.37) FABP4FABP5POLBCASP3SENP7
SCHEMBL7395468 0.96 FABP4 (0.36) FABP4FABP5POLBCASP3SENP7
SCHEMBL7401003 0.88 NPC1 (0.47) POLBCASP3SENP7SENP6HTR3A
SCHEMBL9821920 0.88 NPC1 (0.47) POLBCASP3SENP7SENP6HTR3A
SCHEMBL7395839 0.87 NPC1 (0.37) FABP4FABP5HTR3A
SCHEMBL7401919 0.87 FABP4 (0.38) FABP4FABP5HTR3AKCNH2USP7
SCHEMBL9359531 0.85 ALDH1A1 (0.39) FABP4FABP5POLBCA1CA2
SCHEMBL9359539 0.85 ALDH1A1 (0.39) FABP4FABP5POLBCA1CA2
SCHEMBL9821859 0.84 HCRTR1 (0.40) HTR3A
SCHEMBL7401290 0.84 HCRTR1 (0.40) HTR3A

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
EP-0491770-A1 SUBSTITUTED UREA COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1992-07-01 EP claimed
WO-1991003475-A1 SUBSTITUTED UREA COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1991-03-21 WO claimed
EP-0419397-B1 Substituted urea compounds and their preparation and use NOVO NORDISK AS (DK) 1994-06-08 EP disclosed