SCHEMBL7973459

SCHEMBL7973459

CCCCCCCCOC(=O)C(Br)CCCCBr

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 2/20 0.62
LCK P06239 1/20 0.53
PPARD Q03181 1/20 0.53
ZDHHC20 Q5W0Z9 1/20 0.53
ZDHHC2 Q9UIJ5 1/20 0.53
FAAH O00519 3/20 0.46
NAAA Q02083 1/20 0.46
EPHX1 P07099 1/20 0.43
TSHR P16473 2/20 0.42
DGKA P23743 1/20 0.42
MAPT P10636 2/20 0.41
HCAR2 Q8TDS4 1/20 0.40
RAD52 P43351 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ESR1 P03372 1/20 0.40
AKR1C4 P17516 1/20 0.40
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40

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
SCHEMBL7959961 0.95 ZDHHC7 (0.59) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL7969816 0.93 ZDHHC7 (0.56) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL27043090 0.93 ZDHHC7 (0.70) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL8056261 0.93 ZDHHC7 (0.70) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL8063027 0.93 ZDHHC7 (0.70) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL18831841 0.93 ZDHHC7 (0.70) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL6754117 0.93 ZDHHC7 (0.70) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL7064455 0.90 ZDHHC7 (0.56) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL31206776 0.90 ZDHHC7 (0.65) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL7976159 0.88 ZDHHC7 (0.53) ZDHHC7LCKPPARDZDHHC20ZDHHC2

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