SCHEMBL10797160

SCHEMBL10797160

CCCCCCCCCCCCC(CCCCCCCCCC)COC(=O)OC(=O)OCC(O)CO.[NaH].[NaH]

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
KDM4E B2RXH2 1/20 0.55
DUSP3 P51452 1/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
DGKA P23743 1/20 0.48
USP2 O75604 1/20 0.45
FAAH O00519 4/20 0.43
PLA2G2C Q5R387 1/20 0.42
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
GPR84 Q9NQS5 4/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL10797010 0.85 KDM4E (0.58) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL10800635 0.85 KDM4E (0.58) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL10796843 0.83 KDM4E (0.59) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL27008512 0.81 PRSS1 (0.53) LMNAFAAHPRSS1PRSS2PRSS3
SCHEMBL29240282 0.81 PRSS1 (0.53) LMNAFAAHPRSS1PRSS2PRSS3
SCHEMBL2990536 0.81 PRSS1 (0.53) LMNAFAAHPRSS1PRSS2PRSS3
SCHEMBL26633470 0.81 PRSS1 (0.53) LMNAFAAHPRSS1PRSS2PRSS3
SCHEMBL17921042 0.80 TSHR (0.49) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL8508059 0.79 TSHR (0.53) LMNAPLA2G2CPRSS1PRSS2PRSS3
SCHEMBL5348873 0.79 KDM4E (0.77) LMNAKDM4EDUSP3MEN1KMT2A

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
US-4713487-A ANIONIC SURFACTANTS KAO CORPORATION (JP) 1987-12-15 US disclosed