SCHEMBL9538649

SCHEMBL9538649

CC(=O)Oc1cccc2c1C(=O)c1c(O)cccc1C2=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.64
KMT2A Q03164 5/20 0.64
ALDH1A1 P00352 4/20 0.64
MAPT P10636 4/20 0.64
MAPK1 P28482 3/20 0.64
LMNA P02545 3/20 0.64
HPGD P15428 3/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
TTR P02766 3/20 0.64
KDM4E B2RXH2 3/20 0.64
FTO Q9C0B1 3/20 0.64
HTT P42858 2/20 0.64
USP2 O75604 2/20 0.64
HSP90AA1 P07900 2/20 0.64
HSP90AB1 P08238 2/20 0.64
CASP7 P55210 2/20 0.64
ABCC4 O15439 1/20 0.64
TP53 P04637 1/20 0.64
CHRM2 P08172 1/20 0.64
HTR1A P08908 1/20 0.64

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
SCHEMBL5613348 0.92 ALDH1A1 (0.73) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL11526641 0.91 PIM1 (0.69) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL11101186 0.85 TTR (0.72) MEN1KMT2AALDH1A1MAPTMAPK1
Diacerein SCHEMBL5712120 0.85 MEN1 (0.84) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL23743764 0.84 KMT2A (0.64) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL5857040 0.83 MEN1 (0.67) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL8382011 0.82 MEN1 (0.84) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL17460659 0.82 MAOA (0.56) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL14003223 0.81 TTR (0.71) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL11000611 0.80 KDM4E (0.59) MEN1KMT2AALDH1A1MAPTMAPK1

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-1993005054-A1 OXAZAPHOSPHORINES USEFUL AS ANTITUMOR AGENTS, A PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1993-03-18 WO disclosed