SCHEMBL11615148

SCHEMBL11615148

CC(=O)C(CCCCCCBr)C(C)=O

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.34
PPARD Q03181 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34
FAAH O00519 4/20 0.34
TRPA1 O75762 1/20 0.33
ASAH1 Q13510 1/20 0.33
ZDHHC7 Q9NXF8 1/20 0.31
GPR84 Q9NQS5 3/20 0.31
FFAR1 O14842 1/20 0.31
MAPT P10636 1/20 0.30
PTGS2 P35354 2/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL10576561 0.90 TRPA1 (0.36) TRPA1
SCHEMBL10565850 0.87 GPR84 (0.37) LCKPPARDZDHHC20ZDHHC2FAAH
SCHEMBL7634831 0.84 ZDHHC7 (0.44) FAAHASAH1ZDHHC7CNR1CNR2
SCHEMBL7643063 0.82 TDP1 (0.41) FAAHTRPA1ZDHHC7MAPT
SCHEMBL27645892 0.82 TRPA1 (0.36) TRPA1
SCHEMBL7634025 0.81 FAAH (0.41) FAAHZDHHC7CNR1CNR2
SCHEMBL27861319 0.80 LCK (0.41) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL7931050 0.80 LCK (0.41) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL9697909 0.80 LCK (0.41) LCKPPARDZDHHC20ZDHHC2GPR84
SCHEMBL19745135 0.80 LCK (0.41) LCKPPARDZDHHC20ZDHHC2GPR84

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-4096280-A Arylenedioxy-bis-diketones STERLING DRUG INC. (US) 1978-06-20 US disclosed