SCHEMBL6936918

SCHEMBL6936918

CC(C)CCCCC(C)C(=O)C(C)CCCCC(C)C

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.54
CA1 P00915 4/20 0.50
LMNA P02545 1/20 0.46
LTA4H P09960 1/20 0.39
KDM4C Q9H3R0 2/20 0.38
KDM4A O75164 1/20 0.38
PHF8 Q9UPP1 1/20 0.38
KDM2A Q9Y2K7 1/20 0.38
ACE2 Q9BYF1 1/20 0.35
RARB P10826 1/20 0.34
DEGS1 O15121 1/20 0.34
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP1A2 P05177 1/20 0.33
KDM1A O60341 1/20 0.33

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
SCHEMBL27460729 0.94 BLM (0.60) BLMCA1LMNALTA4HKDM4C
SCHEMBL27415466 0.87 BLM (0.72) BLMCA1LMNAACE2
SCHEMBL1781111 0.81 BLM (0.52) BLMCA1LMNALTA4HKDM4C
SCHEMBL13343956 0.81 BLM (0.78) BLMCA1LMNALTA4HKDM4C
SCHEMBL351185 0.81 CA1 (0.74) CA1ACE2
SCHEMBL891189 0.81 BLM (0.78) BLMCA1LMNALTA4HKDM4C
SCHEMBL1922411 0.79 CA1 (0.71) CA1ACE2
SCHEMBL8042148 0.79 BLM (0.75) BLMLMNALTA4HKDM4CKDM4A
SCHEMBL3211014 0.79 CA1 (0.71) CA1ACE2
SCHEMBL5878707 0.79 BLM (0.75) BLMLMNALTA4HKDM4CKDM4A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0745605-B1 Liquid methyltin halide compositions ATOFINA CHEM INC (US) 2003-04-23 EP disclosed
US-5853799-A Liquid methyltin halide compositions ATOFINA CHEMICALS, INC., A CORP. OF PENNSYLVANIA 1998-12-29 US disclosed
US-5725904-A Liquid methyltin halide compositions ELF ATOCHEM NORTH AMERICA, INC. (US) 1998-03-10 US disclosed
EP-0745605-A2 Liquid methyltin halide compositions ELF ATOCHEM NORTH AMERICA, INC. (US) 1996-12-04 EP disclosed