SCHEMBL7166265

SCHEMBL7166265

CCCCNC(=O)CCC(=O)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.59
HPGD P15428 2/20 0.59
NAAA Q02083 1/20 0.55
MEN1 O00255 2/20 0.54
LMNA P02545 2/20 0.54
KMT2A Q03164 2/20 0.54
L3MBTL1 Q9Y468 3/20 0.54
SMN1; SMN2 Q16637 1/20 0.53
MAPT P10636 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
TSHR P16473 1/20 0.51
HTT P42858 1/20 0.51
HSD17B10 Q99714 1/20 0.51
HDAC1 Q13547 1/20 0.50
CYP2C9 P11712 1/20 0.50

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
SCHEMBL10001149 0.91 SMN1; SMN2 (0.62) HPGDMEN1LMNAKMT2AL3MBTL1
SCHEMBL8496423 0.90 ALDH1A1 (0.63) ALDH1A1HPGDMEN1LMNAKMT2A
SCHEMBL12031270 0.87 SMN1; SMN2 (0.60) HPGDNAAAMEN1LMNAKMT2A
SCHEMBL7542456 0.86 NAAA (0.63) HPGDNAAALMNAL3MBTL1MAPT
SCHEMBL16596169 0.81 NAAA (0.69) ALDH1A1HPGDNAAAMEN1KMT2A
SCHEMBL4761104 0.80 THRA (0.57) HPGDNAAAMEN1LMNAKMT2A
SCHEMBL24648927 0.79 LMNA (0.62) ALDH1A1HPGDLMNAL3MBTL1SMN1; SMN2
SCHEMBL1093862 0.79 HPGD (0.91) HPGDMEN1LMNAKMT2AL3MBTL1
SCHEMBL7327582 0.79 ALDH1A1 (0.55) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
Valerophenone SCHEMBL9725402 0.79 L3MBTL1 (0.72) HPGDLMNAKMT2AL3MBTL1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6566375-B1 For therapy of atherosclerosis WYETH 2003-05-20 US disclosed
US-6316467-B1 Elevation of HDL cholesterol by 4-[(Aminothioxomethyl)-hydrazono]-N-(substituted)-4-arylbutanamides AMERICAN HOME PRODUCTS CORPORATION 2001-11-13 US disclosed
WO-1999025682-A1 ELEVATION OF HDL CHOLESTEROL BY 4-[(AMINOTHIOXOMETHYL) -HYDRAZONO] -N-(SUBSTITUTED) -4-ARYLBUTANAMIDES AMERICAN HOME PRODUCTS CORPORATION (US) 1999-05-27 WO disclosed