SCHEMBL6233828

SCHEMBL6233828

CCCOc1cc(O)c(O)c(C(C)C)c1OCCC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.35
BCL2L1 Q07817 1/20 0.35
MCL1 Q07820 1/20 0.35
BCL2L2 Q92843 1/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
ALOX5 P09917 5/20 0.34
ALDH1A1 P00352 4/20 0.34
HTT P42858 3/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
PTPRC P08575 2/20 0.33
PTPN2 P17706 2/20 0.33
PTPN1 P18031 2/20 0.33
PTPRB P23467 2/20 0.33
PTPN11 Q06124 2/20 0.33
GAA P10253 2/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 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
SCHEMBL6235771 0.92 ESR1 (0.40) BCL2BCL2L1MCL1BCL2L2MEN1
SCHEMBL6231787 0.83 TSHR (0.41) BCL2BCL2L1MCL1BCL2L2MEN1
SCHEMBL6233833 0.80 KMT2A (0.36) MEN1KMT2AALDH1A1MAPTPTPRC
SCHEMBL5590500 0.79 LTA4H (0.34) KMT2APTPRCPTPN2PTPN1PTPRB
SCHEMBL16575430 0.75 MEN1 (0.38) MEN1KMT2AALDH1A1HTTMAPT
SCHEMBL6232977 0.75 ALOX5 (0.48) MEN1KMT2AALOX5
SCHEMBL6258842 0.74 PTGS1 (0.37) MEN1KMT2AALOX5ALDH1A1HTT
SCHEMBL6233829 0.74 CA12 (0.43) MEN1KMT2AALDH1A1PTPN11GAA
SCHEMBL5588576 0.73 TP53 (0.41) MEN1KMT2AALDH1A1MAPTPTPN1
SCHEMBL6233674 0.73 ALOX5 (0.56) MEN1KMT2AALOX5HTTHPGD

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
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO disclosed