SCHEMBL12436366

SCHEMBL12436366

COC(=O)NC(C)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
HPGD P15428 2/20 0.58
HSD17B10 Q99714 2/20 0.58
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
KDM4E B2RXH2 2/20 0.54
LMNA P02545 2/20 0.54
POLB P06746 2/20 0.53
TDP1 Q9NUW8 1/20 0.53
CTDSP1 Q9GZU7 1/20 0.53
RECQL P46063 1/20 0.53
MAPT P10636 1/20 0.53
NPC1 O15118 1/20 0.53
ACACB O00763 1/20 0.53
MMP9 P14780 1/20 0.51
MMP8 P22894 1/20 0.51
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
CASR P41180 1/20 0.51

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
SCHEMBL10117998 1.00 ALDH1A1 (0.58) ALDH1A1HPGDHSD17B10KMT2AMEN1
SCHEMBL10117995 1.00 ALDH1A1 (0.58) ALDH1A1HPGDHSD17B10KMT2AMEN1
SCHEMBL8691251 0.86 ACACB (0.68) HPGDNPC1ACACB
SCHEMBL8691248 0.86 ACACB (0.68) HPGDNPC1ACACB
SCHEMBL8134776 0.83 ALDH1A1 (0.54) ALDH1A1HPGDHSD17B10KMT2AMEN1
SCHEMBL9046891 0.83 ALDH1A1 (0.54) ALDH1A1HPGDHSD17B10KMT2AMEN1
SCHEMBL8701763 0.83 ALDH1A1 (0.54) ALDH1A1HPGDHSD17B10KMT2AMEN1
SCHEMBL15918786 0.82 ACACB (0.55) ALDH1A1HPGDHSD17B10KDM4ELMNA
SCHEMBL23240945 0.82 HSD17B10 (0.51) ALDH1A1HPGDHSD17B10KMT2AMEN1
SCHEMBL12203593 0.82 CTSK (0.62) ALDH1A1HPGDHSD17B10KMT2AMEN1

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
CN-109563509-B Reduced size self-delivering nucleic acid compounds targeting long non-coding RNAs 菲奥医药公司 2022-08-09 CN disclosed
EP-2400846-B1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARM INC (US) 2016-10-05 EP disclosed
WO-2013052369-A1 NOVEL BENZIMIDAZOLE DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2013-04-11 WO disclosed
WO-2011091532-A1 HEPATITIS C INHIBITOR COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-08-04 WO disclosed