SCHEMBL4762267

SCHEMBL4762267

OCc1cccc(C2(c3cccc(CO)c3O)c3ccccc3-c3ccccc32)c1O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 8/20 0.45
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
OPRK1 P41145 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
APOBEC3G Q9HC16 1/20 0.35
GABRA1 P14867 2/20 0.35
GABRB2 P47870 2/20 0.35
APEX1 P27695 1/20 0.33
THRB P10828 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PGR P06401 1/20 0.32

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
SCHEMBL29830420 0.84 PDK2 (0.46) PDK2PDCD1CD274ESR1ESR2
SCHEMBL2909585 0.80 GABRA1 (0.64) KDM4EMEN1LMNAMAPTKMT2A
SCHEMBL2913117 0.77 ALOX5 (0.51)
SCHEMBL10051848 0.76 ESR1 (0.47) PDK2PDCD1CD274ESR1ESR2
SCHEMBL4792150 0.76 ALDH1A1 (0.46) PDK2ESR1ESR2KDM4EMEN1
SCHEMBL29616923 0.76 ALDH1A1 (0.46) PDK2ESR1ESR2KDM4EMEN1
SCHEMBL9418403 0.75 GABRA1 (0.56) PDK2PDCD1CD274KDM4ELMNA
SCHEMBL4762264 0.74 ESR1 (0.41) PDK2ESR1ESR2KDM4EMEN1
SCHEMBL19326650 0.73 SMN1; SMN2 (0.47) PDK2ESR1ESR2KDM4EMEN1
SCHEMBL8889986 0.72 PDCD1 (0.62) PDK2PDCD1CD274KDM4EMEN1

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
JP-2008273844-A NEW FLUORENE COMPOUND HAVING PHENOLIC HYDROXY GROUP AND METHYLOL GROUP AND METHOD FOR PRODUCING THE SAME OSAKA GAS CO LTD 2008-11-13 JP disclosed