SCHEMBL19829243

SCHEMBL19829243

COC(=O)CC(O)(CCC#CC(C)(C)OCc1ccccc1)C(=O)OC

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 4/20 0.34
KDM4E B2RXH2 2/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SRC P12931 1/20 0.32
KAT2B Q92831 1/20 0.31
KCNN4 O15554 1/20 0.31
PTPN1 P18031 1/20 0.31
HTT P42858 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
SCHEMBL19810006 0.89 MEN1 (0.39) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL19810007 0.89 MEN1 (0.39) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL18229666 0.83 ALDH1A1 (0.36) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL18229667 0.83 ALDH1A1 (0.36) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL19810002 0.79 KMT2A (0.40) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL19810004 0.79 KMT2A (0.40) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL20156625 0.77 SLC13A5 (0.32) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL18229652 0.77 MEN1 (0.33) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL18229654 0.77 MEN1 (0.33) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL17200135 0.75 PTPN1 (0.46) MEN1KMT2AALDH1A1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018019549-A1 DIOXOLANONE INTERMEDIATE USEFUL IN THE SYNTHESIS OF HOMOHARRINGTONINE INDENA S.P.A. (IT) 2018-02-01 WO disclosed