SCHEMBL6792849

SCHEMBL6792849

NC(=O)Cc1cccc2c1C(CCCCN1CCN(c3ccc(-c4ccccc4)cc3)CC1)(C(=O)O)c1ccccc1-2

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 3/20 0.41
FAAH O00519 2/20 0.41
HTR7 P34969 9/20 0.40
HTR1A P08908 6/20 0.39
DRD2 P14416 1/20 0.38
DRD5 P21918 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL6790993 0.91 DRD3 (0.40) DRD3FAAHHTR7HTR1ADRD2
SCHEMBL6789354 0.87 HTR1A (0.47) DRD3FAAHHTR7HTR1ADRD2
SCHEMBL6791990 0.86 DRD3 (0.46) DRD3FAAHHTR7HTR1ADRD2
SCHEMBL7047136 0.83 SIGMAR1 (0.43)
SCHEMBL6766932 0.82 HTR1A (0.50) DRD3HTR7HTR1ADRD2
SCHEMBL6771036 0.81 ALDH1A1 (0.40) HTR7
SCHEMBL6795181 0.81 DRD3 (0.46) DRD3FAAHHTR7HTR1ADRD2
SCHEMBL6790535 0.80 HTR1A (0.50) DRD3HTR7HTR1ADRD2DRD5
SCHEMBL6777323 0.78 HTR1A (0.41) DRD3HTR7HTR1ADRD2
SCHEMBL6792470 0.78 HTR7 (0.45) DRD3HTR7HTR1ADRD2DRD5

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6818644-B1 FLUORENE-9-CARBOXYLIC AMIDES; INHIBITORS OF MICROSOMAL TRIGLYSERIDE-TRANSFER PROTEIN (MTP); ANTILIPEMIC AGENTS; ATHEROSCLEROSIS, DIABETES, EATING DISORDERS, AND PANCREATITIS BOEHRINGER INGELHEIM PHARM GMBH & CO, KG (DE) 2004-11-16 US disclosed