SCHEMBL5332916

SCHEMBL5332916

O=C(OC1CCCC1)c1ccccc1OC1CCCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
SCN1A P35498 2/20 0.50
SCN2A Q99250 2/20 0.50
SCN3A Q9NY46 2/20 0.50
KAT2B Q92831 1/20 0.50
BAZ2B Q9UIF8 1/20 0.50
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
MRGPRX1 Q96LB2 1/20 0.47
MMP9 P14780 2/20 0.45
MMP12 P39900 2/20 0.45
MMP1 P03956 1/20 0.45
ALDH1A1 P00352 3/20 0.45
ADRA1A P35348 1/20 0.45
PDE5A O76074 1/20 0.44
MMP2 P08253 1/20 0.44
PTPRF P10586 1/20 0.44
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44

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
SCHEMBL8423858 0.98 MEN1 (0.52) MEN1KMT2ASCN1ASCN2ASCN3A
Ammonia Solution, Strong SCHEMBL27808056 0.98 MEN1 (0.52) MEN1KMT2ASCN1ASCN2ASCN3A
SCHEMBL3361977 0.87 MEN1 (0.55) MEN1KMT2ASCN1ASCN2ASCN3A
SCHEMBL5332642 0.87 PDE5A (0.57) MEN1KMT2AKAT2BBAZ2BMRGPRX1
SCHEMBL31480049 0.86 MAPT (0.50) MEN1KMT2ASCN1ASCN2ASCN3A
SCHEMBL5987325 0.86 MEN1 (0.53) MEN1KMT2ASCN1ASCN2ASCN3A
SCHEMBL8607117 0.85 MEN1 (0.57) MEN1KMT2ASCN1ASCN2ASCN3A
SCHEMBL29372521 0.85 MEN1 (0.57) MEN1KMT2ASCN1ASCN2ASCN3A
SCHEMBL10707097 0.85 MEN1 (0.57) MEN1KMT2ASCN1ASCN2ASCN3A
SCHEMBL31069910 0.85 MEN1 (0.57) MEN1KMT2ASCN1ASCN2ASCN3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007077074-A COMPOSITION CONTAINING SALICYLIC ACID CYCLOPENTYL ESTER NIPPON ZEON CO LTD 2007-03-29 JP disclosed