SCHEMBL3520877

SCHEMBL3520877

O=c1c(O)c(-c2ccccc2)oc2c1C=CCC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 9/20 0.50
KDM4E B2RXH2 9/20 0.50
MEN1 O00255 8/20 0.50
KMT2A Q03164 8/20 0.50
ALOX15 P16050 5/20 0.50
MAPK1 P28482 4/20 0.50
TP53 P04637 4/20 0.50
ABCB1 P08183 4/20 0.50
LMNA P02545 3/20 0.50
CYP1B1 Q16678 3/20 0.50
CA12 O43570 2/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CALM1 P0DP23 1/20 0.50
AR P10275 1/20 0.50
PKM P14618 1/20 0.50
CA9 Q16790 1/20 0.50
MAPT P10636 7/20 0.48
HSD17B10 Q99714 7/20 0.48
HPGD P15428 4/20 0.48

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
SCHEMBL10810958 0.74 KDM4E (0.41) CYP3A4KDM4EMEN1KMT2ALMNA
SCHEMBL30064082 0.71 MAOA (0.50) CYP3A4KDM4EMEN1KMT2AALOX15
SCHEMBL5724043 0.71 CYP1A1 (0.48) CYP3A4KDM4EMEN1KMT2AALOX15
Flavonol SCHEMBL29433939 0.67 KDM4E (1.00) CYP3A4KDM4EMEN1KMT2AALOX15
Flavonol SCHEMBL1679068 0.67 KDM4E (1.00) CYP3A4KDM4EMEN1KMT2AALOX15
Flavonol SCHEMBL20246 0.67 KDM4E (1.00) CYP3A4KDM4EMEN1KMT2AALOX15
Flavonol SCHEMBL21874432 0.66 KDM4E (0.97) CYP3A4KDM4EMEN1KMT2AALOX15
Flavonol SCHEMBL21874433 0.66 KDM4E (0.97) CYP3A4KDM4EMEN1KMT2AALOX15
Flavonol SCHEMBL31570209 0.66 KDM4E (0.97) CYP3A4KDM4EMEN1KMT2AALOX15
Flavonol SCHEMBL31328341 0.66 KDM4E (0.97) CYP3A4KDM4EMEN1KMT2AALOX15

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
US-20100285601-A1 METHOD OF ELECTRICALLY DETECTING A NUCLEIC ACID MOLECULE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2010-11-11 US disclosed
WO-2009041917-A1 METHOD OF ELECTRICALLY DETECTING A NUCLEIC ACID MOLECULE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2009-04-02 WO disclosed