SCHEMBL9548557

SCHEMBL9548557

CCCCCCCCCCCCCCCCC(Br)C(=O)Br

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.69
PPARD Q03181 1/20 0.69
ZDHHC20 Q5W0Z9 1/20 0.69
ZDHHC2 Q9UIJ5 1/20 0.69
ZDHHC7 Q9NXF8 2/20 0.62
GPR84 Q9NQS5 7/20 0.48
FDPS P14324 4/20 0.48
FFAR1 O14842 1/20 0.48
MAPT P10636 1/20 0.47
LAP3 P28838 1/20 0.45
CA2 P00918 1/20 0.45
FAAH O00519 1/20 0.44

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
SCHEMBL5974169 1.00 LCK (0.69) LCKPPARDZDHHC20ZDHHC2ZDHHC7
Hydrochloric Acid SCHEMBL27572307 0.98 LCK (0.67) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL28246883 0.98 LCK (0.65) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL931024 0.91
SCHEMBL23829555 0.82 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL10595854 0.82 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL8937087 0.82 LCK (0.69) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL338237 0.82 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL337479 0.82 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL375050 0.82 LCK (1.00) LCKPPARDZDHHC20ZDHHC2ZDHHC7

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-5196257-A BIDIMENSIONAL ORGANIC DIAPHRAGMS AND THEIR PREPARATION PROCESSES COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 1993-03-23 US disclosed