SCHEMBL11700396

SCHEMBL11700396

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

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.61
MEN1 O00255 1/20 0.58
CYP3A4 P08684 1/20 0.58
ALOX15 P16050 1/20 0.58
KMT2A Q03164 1/20 0.58
PTPN1 P18031 3/20 0.55
PTPN2 P17706 1/20 0.55
CDC25B P30305 1/20 0.55
BLM P54132 1/20 0.45
ACE2 Q9BYF1 1/20 0.31
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
SCHEMBL10340685 0.98 MEN1 (0.60) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL11763986 0.94 LMNA (0.52) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL5201000 0.93 MEN1 (0.60) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL11759786 0.92 MEN1 (0.50) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL16074981 0.91 MEN1 (0.58) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL11668697 0.89 ALOX15 (0.47) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL14047325 0.88 MEN1 (0.55) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL9403709 0.88 MEN1 (0.55) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL10824443 0.85 MEN1 (0.49) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL14047326 0.85 MEN1 (0.56) LMNAMEN1CYP3A4ALOX15KMT2A

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
US-4032588-A REACTING KETONE WITH ACETYLENE, HYDROCRACKING SHISEIDO CO., LTD. (JA) 1977-06-28 US disclosed
US-4011277-A PREPARATION OF SQUALANE BY HYDROGENOLYSIS KURARAY CO., LTD. (JA) 1977-03-08 US disclosed
US-3981930-A Diacetylene diol derivatives and process for preparing the same KURARAY CO., LTD. (JA) 1976-09-21 US disclosed
US-3975451-A Diols and process for preparation thereof KURARAY CO., LTD. (JA) 1976-08-17 US disclosed