SCHEMBL6299352

SCHEMBL6299352

CCc1coc2c(Br)cccc12

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.47
GABRB2 P47870 2/20 0.47
LOXL2 Q9Y4K0 1/20 0.37
TP53 P04637 1/20 0.36
MAOB P27338 6/20 0.36
CA2 P00918 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PFKFB3 Q16875 1/20 0.32
TBXA2R P21731 2/20 0.32
PTGIR P43119 2/20 0.32
PSMB8 P28062 1/20 0.32
PSMB5 P28074 1/20 0.32
CYP1B1 Q16678 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MAOA P21397 1/20 0.31

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
SCHEMBL9843775 0.83 MAOB (0.44) LOXL2MAOBSMN1; SMN2TBXA2RPTGIR
SCHEMBL9843997 0.83 LOXL2 (0.35) GABRA1GABRB2LOXL2MAOB
SCHEMBL21455346 0.81 LOXL2 (0.44) LOXL2MAOBCA2
SCHEMBL23115218 0.79 PKM (0.46) TP53MAOBSMN1; SMN2MEN1KMT2A
SCHEMBL17321025 0.78 CA2 (0.35) GABRA1GABRB2LOXL2CA2TBXA2R
SCHEMBL13298379 0.77 CYP17A1 (0.40) MAOBPSMB8PSMB5MEN1KMT2A
SCHEMBL31534803 0.77 LOXL2 (0.32) LOXL2MAOBTBXA2RPTGIR
SCHEMBL5544888 0.77 LOXL2 (0.33) LOXL2MAOBTBXA2RPTGIR
SCHEMBL25824617 0.76 LOXL2 (0.36) LOXL2MAOB
SCHEMBL806348 0.75 ALDH1A1 (0.54) CA2TBXA2RPTGIRPSMB8PSMB5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6967201-B1 for increasing activation of the 5-HT2C receptor in mammals; treatment of depression, obesity, bulimia, premenstrual syndrome, alcoholism, tobacco abuse, panic disorder ELI LILLY AND COMPANY (US) 2005-11-22 US disclosed
EP-1204654-B1 BENZOFURYLPIPERAZINES: 5-HT2C SEROTONIN RECEPTOR AGONISTS LILLY CO ELI (US) 2003-07-23 EP disclosed
EP-1204654-A1 BENZOFURYLPIPERAZINES AND BENZOFURYLHOMOPIPERAZINES: SEROTONIN AGONISTS ELI LILLY AND COMPANY (US) 2002-05-15 EP disclosed
WO-2001009111-A1 BENZOFURYLPIPERAZINES AND BENZOFURYLHOMOPIPERAZINES: SEROTONIN AGONISTS ELI LILLY AND COMPANY (US) 2001-02-08 WO disclosed