SCHEMBL9514948

SCHEMBL9514948

CCOC(=O)C(Cc1ccc2c(c1)OCCOCCOCCOCCOCCO2)C(=O)OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
MEN1 O00255 2/20 0.47
USP2 O75604 2/20 0.47
LMNA P02545 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPK1 P28482 1/20 0.47
ALDH1A1 P00352 5/20 0.47
POLB P06746 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 2/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
TP53 P04637 1/20 0.46
GLA P06280 1/20 0.46
CYP3A4 P08684 1/20 0.45
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
ATM Q13315 1/20 0.43
ALPL P05186 1/20 0.43
ALOX15 P16050 1/20 0.43

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
SCHEMBL9585882 0.90 CYP3A4 (0.48) MAPTMEN1USP2LMNAKMT2A
SCHEMBL6157430 0.88 CYP3A4 (0.58) MAPTMEN1USP2LMNAKMT2A
SCHEMBL9381254 0.87 MAPT (0.46) MAPTMEN1USP2LMNAKMT2A
SCHEMBL9514872 0.83 KDM4E (0.50) MAPTUSP2LMNAALDH1A1SMN1; SMN2
SCHEMBL7574108 0.83 CYP3A4 (0.56) MAPTMEN1USP2LMNAKMT2A
SCHEMBL7699367 0.82 CYP3A4 (0.58) MAPTMEN1USP2LMNAKMT2A
SCHEMBL11006092 0.81 MAPT (0.46) MAPTMEN1USP2LMNAKMT2A
SCHEMBL3572819 0.77 KMT2A (0.49) MAPTMEN1USP2LMNAKMT2A
SCHEMBL14003499 0.76 CYP3A4 (0.75) MAPTUSP2LMNAKMT2AALDH1A1
SCHEMBL4140012 0.76 RAB9A (0.58) MAPTMEN1USP2LMNAKMT2A

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
EP-0341409-B1 Platinum (II) complexes, their preparation and use as antitumour agents BOEHRINGER MANNHEIM ITALIA (IT) 1993-12-29 EP disclosed