SCHEMBL7218290

SCHEMBL7218290

Oc1ccc(C2(c3ccc(O)cc3)CCCC2(I)I)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 7/20 0.48
ESR1 P03372 4/20 0.48
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
CA12 O43570 1/20 0.33
GMNN O75496 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
LMNA P02545 1/20 0.33
CA3 P07451 1/20 0.33
CYP3A4 P08684 1/20 0.33
TYR P14679 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
NFKB1 P19838 1/20 0.33
CA4 P22748 1/20 0.33
CA5A P35218 1/20 0.33

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
SCHEMBL10453123 0.96 ESR2 (0.54) ESR2ESR1MAPTKDM4EMEN1
SCHEMBL2302149 0.80 ESR2 (0.65) ESR2ESR1MAPTKDM4EMEN1
SCHEMBL5951161 0.72 ESR1 (0.56) ESR2ESR1CA12CA1CA2
SCHEMBL10448710 0.72 ESR2 (0.45) ESR2ESR1MAPTKDM4EMEN1
SCHEMBL11411537 0.71 ESR2 (0.54) ESR2ESR1MAPTKDM4EMEN1
SCHEMBL11325038 0.71 ESR2 (0.54) ESR2ESR1MAPTKDM4EMEN1
SCHEMBL11411530 0.71 ESR2 (0.54) ESR2ESR1MAPTKDM4EMEN1
SCHEMBL10453320 0.71 ESR2 (0.41) ESR2ESR1MAPTALDH1A1HPGD
SCHEMBL8411084 0.70 ESR2 (0.90) ESR2ESR1MAPTKDM4EMEN1
SCHEMBL870311 0.70 ESR2 (0.90) ESR2ESR1MAPTKDM4EMEN1

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
EP-1272565-A2 FLAME-RETARDANT RESIN MOLDING GENERAL ELECTRIC COMPANY (US) 2003-01-08 EP disclosed
WO-2001072905-A2 FLAME-RETARDANT RESIN MOLDING GENERAL ELECTRIC COMPANY (US) 2001-10-04 WO disclosed