SCHEMBL7702832

SCHEMBL7702832

COc1cc[c]c(-c2ccc(O)cc2)c1-c1ccc(O)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGAM O43451 11/20 0.46
GAA P10253 11/20 0.46
SI P14410 11/20 0.46
MGAM2 Q2M2H8 11/20 0.46
ESR2 Q92731 1/20 0.41
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
BACE1 P56817 1/20 0.38
ABL1 P00519 2/20 0.38
ABCB1 P08183 2/20 0.38
BCR P11274 2/20 0.38
HSP90AA1 P07900 1/20 0.38
SENP1 Q9P0U3 1/20 0.37
ERN1 O75460 1/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL7705602 0.84 ACHE (0.35) MGAMGAASIMGAM2
SCHEMBL7708151 0.83 CRHR1 (0.38) GAAHSP90AA1ERN1
SCHEMBL7071376 0.82 PDE4B (0.39) GAAPDE4APDE4BPDE4CPDE4D
SCHEMBL7705600 0.82 SENP1 (0.34) MGAMGAASIMGAM2ESR2
SCHEMBL7702845 0.80 PDGFRB (0.38) GAA
SCHEMBL7705593 0.80 TDO2 (0.35) HSP90AA1
SCHEMBL7707636 0.78 ABCB1 (0.32) ABCB1
SCHEMBL7564424 0.78 ESR2 (0.37) MGAMGAASIMGAM2ESR2
SCHEMBL11802233 0.78 CYP1A2 (0.41) GAAPDE4APDE4BPDE4CPDE4D
SCHEMBL6399757 0.77 SENP1 (0.45) GAAESR2PDE4APDE4BPDE4C

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-6358665-B1 ONIUM SALT PRECURSOR FOR GENERATING FLUOROALKYLSULFONATE CLARIANT INTERNATIONAL LTD. (CH) 2002-03-19 US disclosed
EP-1033624-A1 RADIATION-SENSITIVE COMPOSITION OF CHEMICAL AMPLIFICATION TYPE Clariant International Ltd. (CH) 2000-09-06 EP disclosed