SCHEMBL9620697

SCHEMBL9620697

O=C(O)OC(Br)CCCCCCCCC(Br)OC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
ZDHHC7 Q9NXF8 1/20 0.36
FAAH O00519 4/20 0.35
GPR84 Q9NQS5 7/20 0.32
FFAR1 O14842 1/20 0.32
MAPT P10636 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
ALDH1A1 P00352 1/20 0.30
THRB P10828 1/20 0.30
RECQL P46063 1/20 0.30
GSTK1 Q9Y2Q3 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
SCHEMBL2870643 0.82
SCHEMBL6564566 0.78
SCHEMBL11332209 0.72 FAAH (0.53) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL21811911 0.72 FAAH (0.53) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL21811606 0.72 FAAH (0.53) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL12039226 0.72 FAAH (0.53) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL21811921 0.72 FAAH (0.53) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL9074009 0.70 CA2 (0.32) ZDHHC7FAAHGPR84
SCHEMBL25227883 0.70 GPR84 (0.52) LCKPPARDZDHHC20ZDHHC2ZDHHC7
SCHEMBL1839609 0.70 GPR84 (0.52) 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
EP-0279978-B1 PHARMACEUTICAL COMPOSITIONS CONTAINING ALPHA-HALOGENATED DICARBOXYLIC ACIDS Epis S.A. (CH) 1992-01-02 EP claimed