SCHEMBL6689686

SCHEMBL6689686

O=C(O)C(c1ccccc1)n1ccc2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 9/20 0.51
SLC6A2 P23975 8/20 0.48
NOTUM Q6P988 1/20 0.47
KMT2A Q03164 1/20 0.45
TSHR P16473 1/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.44
NR3C2 P08235 1/20 0.43

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
SCHEMBL11412911 0.80 KMT2A (0.49) SLC6A4SLC6A2NOTUMKMT2ATSHR
SCHEMBL526316 0.77 NOTUM (0.49) SLC6A4SLC6A2NOTUMKMT2ATSHR
SCHEMBL18685611 0.77 SLC6A4 (0.59) SLC6A4SLC6A2
SCHEMBL2886772 0.76 SLC6A4 (0.54) SLC6A4SLC6A2
SCHEMBL2283629 0.75 KMT2A (0.47) SLC6A4SLC6A2NOTUMKMT2ATSHR
SCHEMBL9337141 0.75 KMT2A (0.44) SLC6A4SLC6A2NOTUMKMT2ATSHR
SCHEMBL6987811 0.74 MAPT (0.45) KMT2ATSHRL3MBTL1LMNAGAA
SCHEMBL11307747 0.73 NR3C2 (0.75) SLC6A4SLC6A2NOTUMNR3C2
SCHEMBL30952648 0.73 KMT2A (0.50) SLC6A4SLC6A2NOTUMKMT2ATSHR
SCHEMBL1967791 0.73 SLC6A4 (0.47) SLC6A4SLC6A2NOTUMKMT2ATSHR

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
EP-1324985-A4 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2004-10-06 EP disclosed
EP-1324985-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2003-07-09 EP disclosed
WO-2002028831-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2002-04-11 WO disclosed