SCHEMBL4610693

SCHEMBL4610693

Cc1cc(C)c2cccc(O)c2n1.Cc1cc(C)c2cccc(O)c2n1.O=Cc1c(O)cccc1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
TDP1 Q9NUW8 2/20 0.43
CRHR1 P34998 2/20 0.42
CCR6 P51684 1/20 0.41
PARP1 P09874 2/20 0.40
TNKS O95271 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
ERN1 O75460 5/20 0.40
KMT2A Q03164 3/20 0.40
CYP1A2 P05177 3/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 1/20 0.40
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
OPRK1 P41145 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
2-Phenylphenol SCHEMBL2437644 0.86 KDM4E (0.48) KDM4ETDP1CRHR1CCR6PARP1
2-Phenylphenol SCHEMBL15366864 0.81 DHODH (0.48) KDM4ETDP1CRHR1CCR6KMT2A
SCHEMBL4608470 0.81 ESR1 (0.44) KDM4ETDP1CRHR1CCR6PARP1
SCHEMBL4299350 0.80 KDM4E (0.62) KDM4ETDP1CRHR1PARP1TNKS
SCHEMBL2873413 0.80 KDM4E (0.62) KDM4ETDP1CRHR1PARP1TNKS
SCHEMBL30587187 0.80 KDM4E (0.62) KDM4ETDP1CRHR1PARP1TNKS
SCHEMBL4608814 0.80 ERN1 (0.49) KDM4ETDP1CCR6ERN1KMT2A
SCHEMBL6639684 0.79 CRHR1 (0.48) KDM4ECRHR1CCR6PARP1TNKS
SCHEMBL13312395 0.78 CRHR1 (0.61) KDM4ETDP1CRHR1KMT2ACYP1A2
SCHEMBL4298175 0.78 KDM4E (0.61) KDM4ETDP1CRHR1PARP1TNKS

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-1935919-A1 POLYMER CONTAINING SULFO GROUP AND ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING THE POLYMER Mitsui Chemicals, Inc. (JP) 2008-06-25 EP disclosed