SCHEMBL8249773

SCHEMBL8249773

O=C(NCC(=O)N1CCCCC1)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PREP P48147 4/20 0.59
ALDH1A1 P00352 1/20 0.57
RAB9A P51151 1/20 0.54
OPRK1 P41145 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.51
LMNA P02545 1/20 0.51
NPC1 O15118 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GAA P10253 1/20 0.50
DPP4 P27487 1/20 0.49
KCNH2 Q12809 1/20 0.49
DPP7 Q9UHL4 1/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HTT P42858 1/20 0.49

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
SCHEMBL8253758 0.99 PREP (0.60) PREPALDH1A1RAB9AOPRK1SMN1; SMN2
SCHEMBL8750837 0.96 PREP (0.60) PREPALDH1A1RAB9AOPRK1SMN1; SMN2
SCHEMBL7159251 0.93 PREP (0.59) PREPALDH1A1OPRK1SMN1; SMN2LMNA
SCHEMBL11263011 0.93 PREP (0.59) PREPALDH1A1OPRK1SMN1; SMN2LMNA
SCHEMBL27795955 0.89 PREP (0.56) PREPALDH1A1OPRK1SMN1; SMN2LMNA
SCHEMBL5873672 0.88 GAA (0.55) PREPALDH1A1OPRK1SMN1; SMN2LMNA
SCHEMBL7683566 0.86 GAA (0.54) PREPALDH1A1OPRK1SMN1; SMN2LMNA
SCHEMBL7509784 0.86 PREP (0.54) PREPALDH1A1OPRK1SMN1; SMN2LMNA
SCHEMBL2586953 0.84 L3MBTL1 (0.61) PREPALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL4075221 0.84 SIGMAR1 (0.57) PREPL3MBTL1MEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3963728-A ACYLATION OF NITROGEN CONTAINING COMPOUNDS USING ESTERS KYOWA HAKKO KOGYO CO., LTD. (JA) 1976-06-15 US claimed
WO-2006127702-A2 ANALOGS OF GLYCYL-PROLYL-GLUTAMATE NEUREN PHARMACEUTICALS LIMITED (NZ) 2006-11-30 WO disclosed
US-RE29369-E AMIDE PRODUCT, SALTS OF HYDROXY-SUBSTITUTED PYRIDINE COMPOUNDS KYOWA HAKKO KOGYO CO., LTD. (JA) 1977-08-23 US disclosed
US-4043992-A Method for preparing acylated products KYOWA HAKKO KOGYO CO., LTD. (JA) 1977-08-23 US disclosed
US-3963728-A ACYLATION OF NITROGEN CONTAINING COMPOUNDS USING ESTERS KYOWA HAKKO KOGYO CO., LTD. (JA) 1976-06-15 US disclosed