SCHEMBL3364591

SCHEMBL3364591

COCCN(C)CCCCCCOc1ccc(N(C)S(=O)(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.48
MCOLN3 Q8TDD5 1/20 0.48
FDPS P14324 2/20 0.47
NR2F2 P24468 1/20 0.47
RAB9A P51151 1/20 0.47
HPGD P15428 1/20 0.46
KMT2A Q03164 3/20 0.44
MAPT P10636 3/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 2/20 0.42
HTT P42858 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL3368626 0.90 PGR (0.53) PGRL3MBTL1SMN1; SMN2MCOLN3FDPS
SCHEMBL3365352 0.90 PGR (0.53) PGRL3MBTL1SMN1; SMN2MCOLN3FDPS
SCHEMBL3366148 0.89 FFAR1 (0.52) L3MBTL1SMN1; SMN2FDPSRAB9AHPGD
SCHEMBL3364755 0.89 L3MBTL1 (0.51) PGRL3MBTL1HPGDALDH1A1TP53
SCHEMBL3367242 0.89 PGR (0.52) PGRL3MBTL1SMN1; SMN2MCOLN3FDPS
SCHEMBL7704534 0.89 L3MBTL1 (0.66) PGRL3MBTL1FDPSHPGDKMT2A
SCHEMBL3362435 0.89 PGR (0.54) PGRL3MBTL1SMN1; SMN2MCOLN3FDPS
SCHEMBL3363565 0.87 PGR (0.57) PGRL3MBTL1SMN1; SMN2MCOLN3NR2F2
SCHEMBL3364981 0.86 L3MBTL1 (0.48) L3MBTL1HPGDALDH1A1
SCHEMBL3367719 0.85 LSS (0.52) PGRL3MBTL1SMN1; SMN2MCOLN3NR2F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1303503-B1 ANILINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-01-27 EP disclosed
US-6683201-B2 FOR THERAPY AND PROPHYLAXIS OF HYPERCHOLESTEROLEMIA, HYPERLIPEMIA, ARTERIOSCLEROSIS, VASCULAR DISEASES, MYCOSES, PARASITE INFECTIONS, GALLSTONES, TUMORS AND/OR HYPERPROLIFERATIVE DISORDERS, DIABETES HOFFMANN-LA ROCHE INC. 2004-01-27 US disclosed
EP-1303503-A2 ANILINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-04-23 EP disclosed
WO-2002006189-A2 ANILINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-01-24 WO disclosed