SCHEMBL7960205

SCHEMBL7960205

COC(=O)C(I)CCCCI

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.40
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.33
ABCB1 P08183 1/20 0.32
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
BIRC2 Q13490 1/20 0.30
TSHR P16473 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
SCHEMBL7970973 0.96 CA1 (0.41) ZDHHC7CA1CA2SMN1; SMN2ABCB1
SCHEMBL2865718 0.91 ZDHHC7 (0.45) ZDHHC7CA1CA2SMN1; SMN2ABCB1
SCHEMBL6760312 0.87 CA1 (0.43) ZDHHC7CA1CA2SMN1; SMN2ABCB1
SCHEMBL7068071 0.85
SCHEMBL10796927 0.83 ZDHHC7 (0.58) ZDHHC7CA1CA2ABCB1USP2
SCHEMBL21782585 0.83 CPB2 (0.43) ZDHHC7CA1CA2
SCHEMBL2859567 0.82 SMN1; SMN2 (0.42) ZDHHC7CA1CA2SMN1; SMN2TSHR
SCHEMBL7973143 0.82 CPB2 (0.42) ZDHHC7LMNA
SCHEMBL27962396 0.82 ZDHHC7 (0.61) ZDHHC7CA1CA2ABCB1USP2
SCHEMBL3813654 0.82 ZDHHC7 (0.61) ZDHHC7CA1CA2ABCB1USP2

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