SCHEMBL8678809

SCHEMBL8678809

CCOC(Oc1cc[c]cc1)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
BCHE P06276 3/20 0.33
ACHE P22303 3/20 0.33
PTGS2 P35354 3/20 0.33
LTB4R Q15722 1/20 0.33
LTB4R2 Q9NPC1 1/20 0.33
PBRM1 Q86U86 1/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TAAR1 Q96RJ0 1/20 0.32
HTT P42858 1/20 0.32
SLC7A5 Q01650 1/20 0.31
TSHR P16473 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
SCHEMBL11856502 0.81 LTA4H (0.52) SLC6A4TSHR
SCHEMBL4452437 0.81 PBRM1 (0.35) SLC6A4PBRM1MEN1KMT2ATSHR
SCHEMBL1413359 0.78 PTGS2 (0.44) L3MBTL1BCHEACHEPTGS2LMNA
SCHEMBL27191 0.78 ACHE (0.47) SLC6A4L3MBTL1BCHEACHEPTGS2
SCHEMBL10182877 0.78 SLC7A5 (0.53) SLC6A4LTB4RLTB4R2MEN1KMT2A
SCHEMBL7181023 0.76 MEN1 (0.41) SLC6A4BCHEACHEPTGS2LTB4R
SCHEMBL8678808 0.75 L3MBTL1 (0.33) SLC6A4L3MBTL1BCHEACHEPTGS2
SCHEMBL8300706 0.75 HTT (0.46) SLC6A4L3MBTL1LMNAMEN1KMT2A
SCHEMBL25685898 0.75 LTB4R (0.39) SLC6A4L3MBTL1BCHEACHEPTGS2
Bromide SCHEMBL30327209 0.74 ACHE (0.44) SLC6A4L3MBTL1BCHEACHEPTGS2

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-0835269-A1 OLEFIN POLYMERIZATION PROCESS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-04-15 EP disclosed