SCHEMBL5987073

SCHEMBL5987073

CCOC(=O)Cc1cc(F)cc2ccoc12

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.41
HPGD P15428 2/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
EGFR P00533 2/20 0.39
PTGS2 P35354 2/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAOB P27338 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
TSHR P16473 1/20 0.36
NR4A1 P22736 1/20 0.36
HCAR2 Q8TDS4 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
SCHEMBL4989578 0.86 EGFR (0.47) PKMHPGDMEN1POLBKMT2A
SCHEMBL4982336 0.84 L3MBTL1 (0.40) PKMHPGDHTTEGFRALDH1A1
SCHEMBL24656366 0.78 CYP3A4 (0.36) HPGDPOLBALDH1A1KDM4EMAPT
SCHEMBL2266546 0.78 ICMT (0.37) POLBHTTNPSR1KDM4EMAPT
SCHEMBL21438256 0.76 CFD (0.42) PTGS2MAOB
SCHEMBL5372809 0.76 TRPM8 (0.41) PKMHPGDHTTEGFRALDH1A1
SCHEMBL2263622 0.75 MAPT (0.41) HPGDMEN1POLBHTTKMT2A
SCHEMBL31426293 0.75 PKM (0.41) PKMHPGDMEN1POLBHTT
SCHEMBL29592629 0.75 EGFR (0.56) PKMHPGDMEN1POLBHTT
SCHEMBL21437996 0.75 EGFR (0.56) PKMHPGDMEN1POLBHTT

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
US-7045545-B1 Aminoalkylbenzofurans as serotonin (5-HT(2c)) agonists ELI LILLY AND COMPANY (US) 2006-05-16 US disclosed
EP-1149085-A1 AMINOALKYLBENZOFURANS AS SEROTONIN (5-HT(2C)) AGONISTS ELI LILLY AND COMPANY (US) 2001-10-31 EP disclosed
WO-2000044737-A1 AMINOALKYLBENZOFURANS AS SEROTONIN (5-HT(2C)) AGONISTS ELI LILLY AND COMPANY (US) 2000-08-03 WO disclosed