SCHEMBL7174485

SCHEMBL7174485

O=C(OC1CC1)C1=CCC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 2/20 0.46
MMP9 P14780 3/20 0.39
MMP12 P39900 3/20 0.39
MMP1 P03956 2/20 0.39
MMP2 P08253 2/20 0.39
STS P08842 4/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
SCN1A P35498 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35
SLC6A3 Q01959 1/20 0.35
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
HTT P42858 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
SCHEMBL10455002 0.80 CYP1A2 (0.37) SERPINE1LMNAMEN1KMT2ARAB9A
SCHEMBL28078408 0.79 HDAC2 (0.46) MMP9MMP12MMP1MMP2STS
SCHEMBL8183007 0.77
SCHEMBL7193299 0.75
SCHEMBL11578150 0.74 PTPN1 (0.36) LMNA
SCHEMBL43932 0.71
SCHEMBL1697290 0.71 SERPINE1 (0.43) SERPINE1MMP9MMP12MMP1MMP2
SCHEMBL1481724 0.70
SCHEMBL6960478 0.70
SCHEMBL43992 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1334161-A1 STRUCTURAL HOT MELT MATERIAL AND METHODS L & L Products, Inc. (US) 2003-08-13 EP disclosed
WO-2003022953-A1 STRUCTURAL HOT MELT MATERIAL AND METHODS L & L PRODUCTS, INC. (US) 2003-03-20 WO disclosed