SCHEMBL7576950

SCHEMBL7576950

CCCCOC(=O)C(CC)N(C(C)=O)c1ccc(Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
ALDH1A1 P00352 4/20 0.40
L3MBTL1 Q9Y468 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
HPGD P15428 2/20 0.39
RAB9A P51151 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
MCL1 Q07820 1/20 0.39
GAA P10253 1/20 0.38
CHRNB2 P17787 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA4 P43681 1/20 0.38
TSHR P16473 2/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37

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
SCHEMBL7569876 0.87 FAAH (0.39) ALDH1A1L3MBTL1TDP1SMN1; SMN2NPC1
SCHEMBL7571120 0.87 ALDH1A1 (0.39) ALDH1A1L3MBTL1TDP1SMN1; SMN2NPC1
SCHEMBL7573230 0.86 TSHR (0.45) ALDH1A1L3MBTL1TDP1SMN1; SMN2NPC1
SCHEMBL8599745 0.86 ESR1 (0.39) ALDH1A1L3MBTL1TDP1SMN1; SMN2NPC1
SCHEMBL6448597 0.83 SLC6A2 (0.40) POLBALDH1A1L3MBTL1TDP1SMN1; SMN2
SCHEMBL7570466 0.83 MAPT (0.45) ALDH1A1L3MBTL1TDP1MAPTGAA
SCHEMBL7570565 0.83 ALDH1A1 (0.47) POLBALDH1A1L3MBTL1TDP1SMN1; SMN2
SCHEMBL7570460 0.82 TSHR (0.37) ALDH1A1L3MBTL1TDP1SMN1; SMN2NPC1
SCHEMBL7567342 0.80 CETP (0.40) POLBALDH1A1L3MBTL1TDP1SMN1; SMN2
SCHEMBL6136368 0.79 HTT (0.41) POLBALDH1A1TDP1SMN1; SMN2KDM4E

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
WO-1998022494-A9 METHODS AND COMPOUNDS FOR INHIBITING β-AMYLOID PEPTIDE RELEASE AND/OR SYNTHESIS 1998-08-20 WO disclosed