SCHEMBL11489686

SCHEMBL11489686

CON(C)C(=O)c1ccccc1Sc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 1/20 0.54
SLC6A9 P48067 5/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 2/20 0.43
HPGD P15428 1/20 0.43
F2 P00734 1/20 0.42
F10 P00742 1/20 0.42
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
ICAM1 P05362 1/20 0.39
SELE P16581 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
MMP12 P39900 1/20 0.38

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
SCHEMBL11749787 0.83 SIRT1 (0.61) SIRT1SLC6A9L3MBTL1ALDH1A1MEN1
SCHEMBL18920337 0.83 POLB (0.50) L3MBTL1ALDH1A1MEN1KMT2AMAPT
SCHEMBL306171 0.82 KMT2A (0.56) L3MBTL1ALDH1A1MEN1KMT2AHPGD
SCHEMBL13680415 0.79 SMN1; SMN2 (0.55) L3MBTL1ALDH1A1KMT2A
SCHEMBL5887723 0.77 SIRT1 (0.61) SIRT1L3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL11755604 0.76 SIRT1 (0.56) SIRT1SLC6A9L3MBTL1ALDH1A1MEN1
SCHEMBL11751601 0.76 SIRT1 (0.56) SIRT1SLC6A9L3MBTL1ALDH1A1MAPT
SCHEMBL8578042 0.75 L3MBTL1 (0.47) L3MBTL1ALDH1A1MEN1KMT2AMAPT
SCHEMBL2417850 0.74 SIRT1 (0.67) SIRT1SLC6A9L3MBTL1ALDH1A1MEN1
SCHEMBL11755847 0.74 TP53 (0.65) SIRT1SLC6A9L3MBTL1MAPTF2

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
US-4208205-A Herbicidal benzamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-06-17 US disclosed