SCHEMBL7208632

SCHEMBL7208632

CCCCOC(=O)OC1CC(=O)NC1=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.46
CRBN Q96SW2 3/20 0.39
DDB1 Q16531 1/20 0.39
NAAA Q02083 2/20 0.38
ELANE P08246 1/20 0.37
ALDH1A1 P00352 2/20 0.37
KMT2A Q03164 2/20 0.36
POLB P06746 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
PKM P14618 1/20 0.35
ATM Q13315 1/20 0.35
MEN1 O00255 1/20 0.34
HIF1A Q16665 1/20 0.34

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
SCHEMBL2037669 0.96 NAAA (0.43) NPC1NAAAALDH1A1KMT2ALMNA
SCHEMBL7278778 0.94 NAAA (0.45) NPC1NAAA
SCHEMBL1949591 0.89 LMNA (0.41) NPC1NAAALMNAMAPTPKM
SCHEMBL1280223 0.88 LMNA (0.40) NPC1NAAALMNAMAPTPKM
SCHEMBL16049982 0.84 ALDH1A1 (0.39) NPC1ALDH1A1KMT2APOLBLMNA
SCHEMBL1727857 0.81 GLA (0.32) NPC1
SCHEMBL9204462 0.80 NAAA (0.41) NPC1NAAAALDH1A1
SCHEMBL5816927 0.80 POLB (0.35) NPC1CRBNDDB1POLB
SCHEMBL10630839 0.79 NAAA (0.40) NPC1NAAAALDH1A1
SCHEMBL3151670 0.78 POLB (0.32) POLB

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
EP-1272500-A2 PROCESS FOR PREPARING 6-O-ALKENYL-SUBSITUTED ERYTHROMYCIN DERIVATIVES Abbott Laboratories (US) 2003-01-08 EP disclosed
WO-2001040163-A1 A PROCESS FOR PRODUCING AMINE COMPOUND WITH t-BUTOXYCARBONYL GROUP KOREA FINE CHEMICAL CO.,LTD. (KR) 2001-06-07 WO disclosed
WO-2000078773-A2 PROCESS FOR PREPARING 6-O-ALKENYL-SUBSTITUTED ERYTHROMYCIN DERIV ATIVES ABBOTT LABORATORIES (US) 2000-12-28 WO disclosed