SCHEMBL7401290

SCHEMBL7401290

Cc1noc(-c2ccccc2N(C(N)=O)C2CC3CCC(C2)N3C)n1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 13/20 0.40
HCRTR2 O43614 13/20 0.40
KMT2A Q03164 1/20 0.39
HTR3E A5X5Y0 1/20 0.37
HTR3B O95264 1/20 0.37
CHRNA7 P36544 1/20 0.37
HTR3A P46098 1/20 0.37
HTR3D Q70Z44 1/20 0.37
HTR3C Q8WXA8 1/20 0.37

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
SCHEMBL9821859 1.00 HCRTR1 (0.40) HCRTR1HCRTR2KMT2AHTR3EHTR3B
SCHEMBL9821867 0.89 RAB9A (0.48) KMT2A
SCHEMBL7399041 0.89 RAB9A (0.48) KMT2A
SCHEMBL7395468 0.88 FABP4 (0.36) HTR3EHTR3BCHRNA7HTR3AHTR3D
SCHEMBL9821920 0.85 NPC1 (0.47) HTR3A
SCHEMBL7401003 0.85 NPC1 (0.47) HTR3A
SCHEMBL9363873 0.84 FABP4 (0.37) HTR3A
SCHEMBL7396015 0.84 FABP4 (0.37) HTR3A
SCHEMBL9821927 0.84 TDP1 (0.41)
SCHEMBL7397762 0.84 TDP1 (0.41)

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 disclosed
EP-0419397-A1 Substituted urea compounds and their preparation and use NOVO NORDISK A/S (DK) 1991-03-27 EP disclosed
WO-1991003475-A1 SUBSTITUTED UREA COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1991-03-21 WO disclosed