SCHEMBL28045239

SCHEMBL28045239

Oc1ccc(C2(Cl)CCCC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 8/20 0.60
ESR1 P03372 6/20 0.60
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
CA12 O43570 1/20 0.38
GMNN O75496 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
LMNA P02545 1/20 0.38
CA3 P07451 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
TYR P14679 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
NFKB1 P19838 1/20 0.38
CA4 P22748 1/20 0.38
CA5A P35218 1/20 0.38

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
SCHEMBL11026382 0.85 ESR1 (0.42) ESR2ESR1ALDH1A1SLC6A2SLC6A4
SCHEMBL11411530 0.76 ESR2 (0.54) ESR2ESR1ALDH1A1KDM4EMEN1
SCHEMBL120895 0.75 ESR2 (1.00) ESR2ESR1ALDH1A1KDM4EMEN1
SCHEMBL2302149 0.75 ESR2 (0.65) ESR2ESR1ALDH1A1KDM4EMEN1
SCHEMBL10730175 0.74 SRD5A2 (0.38) ESR2ESR1ALDH1A1NPC1LMNA
SCHEMBL9838333 0.73 ESR2 (0.95) ESR2ESR1ALDH1A1KDM4EMEN1
SCHEMBL13379655 0.73 ESR2 (1.00) ESR2ESR1ALDH1A1KDM4EMEN1
SCHEMBL13379656 0.73 ESR2 (1.00) ESR2ESR1ALDH1A1KDM4EMEN1
SCHEMBL10777847 0.73 ESR2 (1.00) ESR2ESR1ALDH1A1KDM4EMEN1
SCHEMBL13379657 0.73 ESR2 (1.00) ESR2ESR1ALDH1A1KDM4EMEN1

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
CN-105165823-A Enhanced Retention Capabilities Through Methods Comprising Surface Treatment Of Functional Particulate Carrier Materials, And Functional Particulate Carrier Materials Made Therefrom WORLD MINERALS INC 2015-12-23 CN disclosed