SCHEMBL7976159

SCHEMBL7976159

CCCCOC(=O)C(Br)CCCBr

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 2/20 0.53
ALDH1A1 P00352 1/20 0.45
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
ATM Q13315 2/20 0.42
TSHR P16473 3/20 0.40
HPGD P15428 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
FAAH O00519 2/20 0.39
CYP3A4 P08684 1/20 0.39
HCAR2 Q8TDS4 1/20 0.38
NAAA Q02083 1/20 0.37
DGKA P23743 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ESR1 P03372 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
EPHX1 P07099 1/20 0.35

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
SCHEMBL7969816 0.95 ZDHHC7 (0.56) ZDHHC7ALDH1A1LCKPPARDZDHHC20
SCHEMBL7959961 0.93 ZDHHC7 (0.59) ZDHHC7ALDH1A1LCKPPARDZDHHC20
SCHEMBL7064275 0.91 ZDHHC7 (0.50) ZDHHC7ALDH1A1LCKPPARDZDHHC20
SCHEMBL1415620 0.90 ZDHHC7 (0.58) ZDHHC7ALDH1A1LCKPPARDZDHHC20
SCHEMBL8056492 0.90 ZDHHC7 (0.58) ZDHHC7ALDH1A1LCKPPARDZDHHC20
SCHEMBL1415492 0.90 ZDHHC7 (0.63) ZDHHC7ALDH1A1LCKPPARDZDHHC20
SCHEMBL1415328 0.88 ZDHHC7 (0.55) ZDHHC7ALDH1A1LCKPPARDZDHHC20
SCHEMBL7973459 0.88 ZDHHC7 (0.62) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL29010105 0.87 ZDHHC7 (0.70) ZDHHC7ALDH1A1LCKPPARDZDHHC20
SCHEMBL11359475 0.86 ZDHHC7 (0.53) ZDHHC7ALDH1A1LCKPPARDZDHHC20

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-6172234-B1 Optically active cyclic amino acid ester derivatives and processes for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-01-09 US disclosed
EP-0976729-A1 Optically active cyclic amino acid ester derivatives and processes for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-02 EP disclosed