SCHEMBL6692371

SCHEMBL6692371

NC(=O)C1=C(c2ccccc2)CCCC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 11/20 0.57
SLC6A2 P23975 8/20 0.57
SLC6A4 P31645 1/20 0.57
BCAT2 O15382 1/20 0.41
MAPT P10636 2/20 0.40
POLB P06746 1/20 0.40
CYP3A4 P08684 1/20 0.40
PARP1 P09874 1/20 0.40
TSHR P16473 1/20 0.40
CYP2C19 P33261 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HTT P42858 1/20 0.40
LIMK1 P53667 1/20 0.40

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
SCHEMBL4350863 0.84 SLC6A3 (0.65) SLC6A3SLC6A2SLC6A4FGF23PTGS2
SCHEMBL1752157 0.84 SLC6A3 (0.65) SLC6A3SLC6A2SLC6A4FGF23PTGS2
SCHEMBL4350872 0.84 SLC6A3 (0.65) SLC6A3SLC6A2SLC6A4FGF23PTGS2
SCHEMBL1752156 0.84 SLC6A3 (0.65) SLC6A3SLC6A2SLC6A4FGF23PTGS2
SCHEMBL1751614 0.84 SLC6A3 (0.65) SLC6A3SLC6A2SLC6A4FGF23PTGS2
SCHEMBL1751676 0.84 SLC6A3 (0.65) SLC6A3SLC6A2SLC6A4FGF23PTGS2
SCHEMBL4198945 0.81 SLC6A3 (0.64) SLC6A3SLC6A2SLC6A4ALDH1A1PTGS2
SCHEMBL17972851 0.81 SLC6A3 (0.61) SLC6A3SLC6A2SLC6A4MAPTSMN1; SMN2
SCHEMBL1751726 0.80 SLC6A3 (0.60) SLC6A3SLC6A2SLC6A4FGF23PTGS2
SCHEMBL4282335 0.78 SLC6A3 (0.64) SLC6A3SLC6A2SLC6A4PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1472226-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-03 EP disclosed
WO-2003045921-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-06-05 WO disclosed