SCHEMBL15501199

SCHEMBL15501199

OCCOCCOc1cc2ccccc2cc1OCCOCCO

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
MAPK1 P28482 2/20 0.53
TDP1 Q9NUW8 1/20 0.53
ALDH1A1 P00352 6/20 0.47
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
MAPT P10636 1/20 0.46
RECQL P46063 1/20 0.45
PTK2B Q14289 1/20 0.44
APP P05067 4/20 0.44
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
NCF1 P14598 3/20 0.42
IDO1 P14902 1/20 0.41
USP2 O75604 1/20 0.41
CYP3A4 P08684 1/20 0.41
CASP1 P29466 1/20 0.41

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
SCHEMBL9041514 0.88 ALDH1A1 (0.58) KDM4EMAPK1TDP1ALDH1A1MAPT
Anthracene SCHEMBL29269289 0.86 MEN1 (0.52) KDM4EMAPK1TDP1ALDH1A1KMT2A
SCHEMBL18433187 0.84 KDM4E (0.40) KDM4EMAPK1TDP1ALDH1A1KMT2A
SCHEMBL30851156 0.84 LMNA (0.56) KDM4EMAPK1ALDH1A1KMT2AMEN1
SCHEMBL3336500 0.84 LMNA (0.56) KDM4EMAPK1ALDH1A1KMT2AMEN1
SCHEMBL7751521 0.84 LMNA (0.56) KDM4EMAPK1ALDH1A1KMT2AMEN1
SCHEMBL9350004 0.83 ALDH1A1 (0.70) KDM4EMAPK1TDP1ALDH1A1KMT2A
SCHEMBL28913779 0.82 KDM4E (0.52) KDM4EMAPK1TDP1ALDH1A1KMT2A
SCHEMBL9492894 0.81 KDM4E (0.82) KDM4EMAPK1TDP1ALDH1A1SMN1; SMN2
SCHEMBL16021984 0.81 KDM4E (0.82) KDM4EMAPK1TDP1ALDH1A1SMN1; SMN2

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-2163949-B1 Developer for lithographic printing plate precursor and process for producing lithographic printing plate FUJIFILM CORP (JP) 2014-03-12 EP disclosed