SCHEMBL11668697

SCHEMBL11668697

CC(C)CCCC(C)(O)CCCCC(C)(O)CCCC(C)C

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.47
MEN1 O00255 1/20 0.47
CYP3A4 P08684 1/20 0.47
KMT2A Q03164 1/20 0.47
PTPN2 P17706 1/20 0.46
PTPN1 P18031 1/20 0.46
CDC25B P30305 1/20 0.46
LMNA P02545 1/20 0.39
ALDH1A1 P00352 2/20 0.33
BLM P54132 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31

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
SCHEMBL8212898 0.94 MEN1 (0.47) ALOX15MEN1CYP3A4KMT2APTPN2
SCHEMBL10340685 0.91 MEN1 (0.60) ALOX15MEN1CYP3A4KMT2APTPN2
SCHEMBL11700396 0.89 LMNA (0.61) ALOX15MEN1CYP3A4KMT2APTPN2
SCHEMBL11802898 0.89 PTPN2 (0.41) ALOX15MEN1CYP3A4KMT2APTPN2
SCHEMBL18879140 0.89 PTPN2 (0.41) ALOX15MEN1CYP3A4KMT2APTPN2
SCHEMBL13619175 0.87 PTPN1 (0.42) ALOX15MEN1CYP3A4KMT2APTPN2
SCHEMBL5018789 0.87 PTPN1 (0.42) ALOX15MEN1CYP3A4KMT2APTPN2
SCHEMBL8207766 0.87 ALDH1A1 (0.48) ALOX15MEN1CYP3A4KMT2APTPN2
SCHEMBL19161296 0.87 SPHK1 (0.41) ALOX15MEN1CYP3A4KMT2APTPN2
SCHEMBL11763986 0.87 LMNA (0.52) ALOX15MEN1CYP3A4KMT2APTPN2

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
JP-52083704-A None JP disclosed
JP-52083704-A None JP disclosed
JP-S5283704-A 2, 6, 11, 15-TETRAMETHYLHEXADECANE-6, 11-DIOL KURARAY CO LTD 1977-07-12 JP disclosed
JP-S5283704-A 2, 6, 11, 15-TETRAMETHYLHEXADECANE-6, 11-DIOL KURARAY CO LTD 1977-07-12 JP disclosed