SCHEMBL6614527

SCHEMBL6614527

O=C1CC(CCN2CCC(Cc3cc(Cl)ccc3Br)CC2)NC(=O)N1c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 16/20 0.43
SLC6A2 P23975 4/20 0.43
HTR1A P08908 13/20 0.42
ACHE P22303 1/20 0.39
DRD2 P14416 1/20 0.36
HTR2A P28223 1/20 0.36
HTR7 P34969 1/20 0.36
HTR6 P50406 1/20 0.36

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
SCHEMBL6614632 0.91 SLC6A4 (0.40) SLC6A4SLC6A2HTR1AACHEDRD2
SCHEMBL6615341 0.89 SLC6A4 (0.42) SLC6A4HTR1ADRD2HTR2AHTR7
SCHEMBL6614898 0.87 HTR1A (0.59) SLC6A4HTR1A
SCHEMBL6615152 0.86 ALDH1A1 (0.47) SLC6A4SLC6A2HTR1AACHE
SCHEMBL6616451 0.85 HTR1A (0.49) SLC6A4HTR1A
SCHEMBL6417415 0.85 SLC6A4 (0.44) SLC6A4SLC6A2HTR1AACHE
SCHEMBL6411104 0.85 SLC6A4 (0.44) SLC6A4SLC6A2HTR1AACHE
SCHEMBL6615662 0.85 HTR1A (0.49) SLC6A4HTR1A
SCHEMBL6618608 0.82 SLC6A4 (0.42) SLC6A4SLC6A2HTR1A
SCHEMBL6614326 0.81 SLC6A4 (0.42) SLC6A4SLC6A2HTR1AACHEDRD2

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
EP-1466901-A1 SEROTONINE REUPTAKE INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-10-13 EP disclosed