SCHEMBL11299798

SCHEMBL11299798

CCCCC1(C(N)=O)CCCCCC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CETP P11597 7/20 0.47
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
CYP2C19 P33261 1/20 0.36
LMNA P02545 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
SPHK1 Q9NYA1 3/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SLC6A5 Q9Y345 1/20 0.32

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
SCHEMBL1858688 1.00 CETP (0.47) CETPCYP4F2CYP4A11CYP2C19LMNA
Hydrochloric Acid SCHEMBL28085803 0.98 CETP (0.46) CETPCYP4F2CYP4A11CYP2C19LMNA
SCHEMBL11359161 0.98 CETP (0.44) CETPCYP4F2CYP4A11CYP2C19SPHK1
SCHEMBL12273729 0.94 CETP (0.41) CETPCYP4F2CYP4A11SPHK1
SCHEMBL9224709 0.92 CETP (0.48) CETPCYP4F2CYP4A11SPHK1
SCHEMBL123159 0.92 CETP (0.48) CETPCYP4F2CYP4A11SPHK1
SCHEMBL15913813 0.92 CETP (0.48) CETPCYP4F2CYP4A11SPHK1
SCHEMBL21806006 0.92 CETP (0.48) CETPCYP4F2CYP4A11SPHK1
SCHEMBL3738398 0.92 CETP (0.48) CETPCYP4F2CYP4A11SPHK1
SCHEMBL10437388 0.92 CETP (0.48) CETPCYP4F2CYP4A11SPHK1

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
US-4318900-A STIMULANTS WILKINSON SWORD LIMITED (GB) 1982-03-09 US disclosed
US-4248859-A USED IN EDIBLE AND TOPICAL PREPARATIONS WILKINSON SWORD LIMITED (GB) 1981-02-03 US disclosed