SCHEMBL6332841

SCHEMBL6332841

C[C@@H]1CNCC[C@@H]1c1c(F)c(F)cc2ccoc12

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EED O75530 1/20 0.33
PRKCQ Q04759 1/20 0.32
HTR2A P28223 2/20 0.31
HTR2C P28335 2/20 0.31
HTR1A P08908 1/20 0.31
DRD3 P35462 1/20 0.31
HTR2B P41595 1/20 0.31
HTR6 P50406 1/20 0.31
P2RY14 Q15391 1/20 0.31
SLC6A2 P23975 2/20 0.30
SLC6A4 P31645 2/20 0.30
SLC6A3 Q01959 2/20 0.30
CYP2D6 P10635 1/20 0.30

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
SCHEMBL6332833 1.00 EED (0.33) EEDPRKCQHTR2AHTR2CHTR1A
SCHEMBL6332836 1.00 EED (0.33) EEDPRKCQHTR2AHTR2CHTR1A
Hydrochloric Acid SCHEMBL6333080 0.99 EED (0.33) EEDPRKCQHTR2AHTR2CHTR1A
Hydrochloric Acid SCHEMBL6333078 0.99 EED (0.33) EEDPRKCQHTR2AHTR2CHTR1A
Hydrochloric Acid SCHEMBL6333083 0.99 EED (0.33) EEDPRKCQHTR2AHTR2CHTR1A
SCHEMBL6334206 0.84 EED (0.37) EEDPRKCQHTR2AHTR2CHTR1A
SCHEMBL6334203 0.84 EED (0.37) EEDPRKCQHTR2AHTR2CHTR1A
SCHEMBL6334205 0.84 EED (0.37) EEDPRKCQHTR2AHTR2CHTR1A
SCHEMBL6331237 0.83 HTR2C (0.37) EEDPRKCQHTR2AHTR2CHTR6
Hydrochloric Acid SCHEMBL6333196 0.83 EED (0.36) EEDPRKCQHTR2AHTR2CHTR1A

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-6881733-B1 Serotonergic benzofurans ELI LILLY AND COMPANY (US) 2005-04-19 US disclosed
EP-1204659-B1 SEROTONERGIC BENZOFURANS LILLY CO ELI (US) 2003-11-26 EP disclosed
EP-1204659-A2 SEROTONERGIC BENZOFURANS ELI LILLY AND COMPANY (US) 2002-05-15 EP disclosed
WO-2001009122-A2 SEROTONERGIC BENZOFURANS ELI LILLY AND COMPANY (US) 2001-02-08 WO disclosed