SCHEMBL9259836

SCHEMBL9259836

CC(C)CCCNCCCCCC(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 2/20 0.53
KDM4A O75164 1/20 0.53
PHF8 Q9UPP1 1/20 0.53
KDM2A Q9Y2K7 1/20 0.53
ADRA1A P35348 1/20 0.50
PRMT1 Q99873 1/20 0.48
PLA2G10 O15496 2/20 0.46
TSHR P16473 5/20 0.46
LMNA P02545 1/20 0.46
NFKB1 P19838 1/20 0.46
PMP22 Q01453 1/20 0.46
GPR84 Q9NQS5 6/20 0.43
PPARG P37231 6/20 0.43
PPARD Q03181 6/20 0.43
PPARA Q07869 6/20 0.43
HDAC11 Q96DB2 5/20 0.43
ALDH1A1 P00352 2/20 0.43
TLR2 O60603 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
FABP4 P15090 2/20 0.43

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
SCHEMBL11417162 0.96 KDM4C (0.57) KDM4CKDM4APHF8KDM2AADRA1A
SCHEMBL11424767 0.92 KDM4C (0.53) KDM4CKDM4APHF8KDM2AADRA1A
Diethanolamine SCHEMBL29392049 0.85 KDM4C (0.54) KDM4CKDM4APHF8KDM2AADRA1A
SCHEMBL29115757 0.85 PLA2G10 (0.55) KDM4CKDM4APHF8KDM2APLA2G10
SCHEMBL254102 0.83 KDM4C (0.63) KDM4CKDM4APHF8KDM2ATSHR
Adipic Acid SCHEMBL18794878 0.83 KDM4C (0.63) KDM4CKDM4APHF8KDM2ATSHR
SCHEMBL1115875 0.83 KDM4C (0.63) KDM4CKDM4APHF8KDM2ATSHR
SCHEMBL15489 0.83 KDM4C (0.63) KDM4CKDM4APHF8KDM2ATSHR
SCHEMBL399776 0.83 KDM4C (0.63) KDM4CKDM4APHF8KDM2ATSHR
SCHEMBL17867194 0.83 KDM4C (0.63) KDM4CKDM4APHF8KDM2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5391564-A E.g., rhizoxin-13-yl 3-methylthiopropionate; anticarcinogenic agents SANKYO COMPANY, LIMITED (JP) 1995-02-21 US disclosed
US-5352689-A Rhizoxin derivatives and their use as anti-tumor agents SANKYO COMPANY, LIMITED (JP) 1994-10-04 US disclosed
EP-0350315-B1 RHIZOXIN DERIVATES AND THEIR USE AS ANTI-TUMOR AGENTS SANKYO COMPANY LIMITED (JP) 1993-06-16 EP disclosed
EP-0350315-A1 Rhizoxin derivates and their use as anti-tumor agents SANKYO COMPANY LIMITED (JP) 1990-01-10 EP disclosed