SCHEMBL30516896

SCHEMBL30516896

CCCCCCCCc1ccc(CCCCCCCCO)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.53
LMNA P02545 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TSHR P16473 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HSD17B10 Q99714 2/20 0.48
MAPT P10636 3/20 0.47
TYR P14679 2/20 0.47
CYP3A4 P08684 2/20 0.47
TP53 P04637 1/20 0.47
ALOX5 P09917 1/20 0.47
ALOX15 P16050 1/20 0.47
HTT P42858 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 1/20 0.45
USP2 O75604 1/20 0.45
GLA P06280 1/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL11779245 0.90 LIPG (0.57) LIPGMEN1KMT2ATSHRALDH1A1
SCHEMBL30537736 0.90 LIPG (0.57) LIPGMEN1KMT2ATSHRALDH1A1
SCHEMBL17537959 0.90 POLB (0.41) LIPGLMNAKMT2ATSHRALDH1A1
SCHEMBL17537717 0.90 POLB (0.41) LIPGLMNAKMT2ATSHRALDH1A1
SCHEMBL17537958 0.88 POLB (0.44) LIPGLMNAKMT2ATSHRALDH1A1
SCHEMBL17537712 0.88 POLB (0.42) LIPGTSHRALDH1A1HSD17B10MAPT
SCHEMBL3677393 0.88 LIPG (0.53) LIPGMEN1KMT2ATSHRALDH1A1
SCHEMBL17537715 0.86 POLB (0.39) LIPGLMNAKMT2ATSHRALDH1A1
SCHEMBL17537718 0.86 POLB (0.39) LIPGLMNAKMT2ATSHRALDH1A1
SCHEMBL17537960 0.86 POLB (0.45) TSHRALDH1A1HSD17B10MAPTTDP1

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
CN-116496289-A Synthesis and application of membrane-targeted naphthalene endoperoxides 大连理工大学 2023-07-28 CN disclosed