SCHEMBL8914351

SCHEMBL8914351

CCCCCCCCCCCCCCC(Br)C(O)CC(=O)OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.57
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
GPR84 Q9NQS5 7/20 0.43
ABCB1 P08183 1/20 0.42
MEN1 O00255 1/20 0.42
HPGD P15428 1/20 0.42
RECQL P46063 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
FAAH O00519 4/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
FFAR1 O14842 1/20 0.42
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
BIRC2 Q13490 1/20 0.41
ASAH1 Q13510 1/20 0.41

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
SCHEMBL28169570 0.81 ABCB1 (0.47) ZDHHC7GPR84ABCB1MEN1HPGD
SCHEMBL27782107 0.81 ZDHHC7 (0.49) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL7020332 0.81 ZDHHC7 (0.58) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL10774516 0.81 GPR84 (0.61) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL4809286 0.80 ZDHHC7 (0.57) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL7599552 0.79 GPR84 (0.63) ZDHHC7GPR84MEN1HPGDRECQL
SCHEMBL7603091 0.79 GPR84 (0.63) ZDHHC7GPR84MEN1HPGDRECQL
SCHEMBL7601123 0.79 GPR84 (0.63) ZDHHC7GPR84MEN1HPGDRECQL
SCHEMBL7603422 0.79 GPR84 (0.63) ZDHHC7GPR84MEN1HPGDRECQL
3-Hydroxyhexadecanoic Acid Methyl Ester SCHEMBL1901941 0.79 GPR84 (0.63) ZDHHC7GPR84MEN1HPGDRECQL

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
JP-9110788-A None JP disclosed
JP-H09110788-A NEW ALKYL 3-OXOALKANOATE AND ITS PRODUCTION L'OREAL SA 1997-04-28 JP disclosed