SCHEMBL11043579

SCHEMBL11043579

O=C(c1ccc(O)cc1)c1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.83
LMNA P02545 2/20 0.83
MAPT P10636 2/20 0.83
ESR2 Q92731 2/20 0.83
HTT P42858 2/20 0.83
PKM P14618 1/20 0.83
HPGD P15428 1/20 0.83
MEN1 O00255 1/20 0.82
RAB9A P51151 1/20 0.82
KMT2A Q03164 1/20 0.82
SRD5A2 P31213 2/20 0.68
HSD17B1 P14061 1/20 0.65
MAPK1 P28482 1/20 0.65
MMP2 P08253 1/20 0.63
MMP3 P08254 1/20 0.63
PDPK1 O15530 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.56
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA12 O43570 1/20 0.55

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
SCHEMBL13297325 1.00 ESR1 (0.83) ESR1LMNAMAPTESR2HTT
SCHEMBL3470674 1.00 ESR1 (0.83) ESR1LMNAMAPTESR2HTT
SCHEMBL6420024 1.00 ESR1 (0.83) ESR1LMNAMAPTESR2HTT
SCHEMBL4671519 1.00 ESR1 (0.83) ESR1LMNAMAPTESR2HTT
SCHEMBL10535107 1.00 ESR1 (0.83) ESR1LMNAMAPTESR2HTT
SCHEMBL699850 0.91 LMNA (1.00) ESR1LMNAMAPTESR2HTT
SCHEMBL18423 0.91 LMNA (1.00) ESR1LMNAMAPTESR2HTT
SCHEMBL2214895 0.91 RAB9A (1.00) ESR1LMNAMAPTESR2HTT
SCHEMBL7929339 0.91 MAPT (0.91) ESR1LMNAMAPTESR2HTT
SCHEMBL10871402 0.89 LMNA (0.67) ESR1LMNAMAPTESR2HTT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0057503-B1 PRODUCTION OF HYDROXY ARYLOPHENONES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-03-20 EP disclosed
US-4453010-A Production of hydroxy arylophenones IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-06-05 US disclosed
EP-0075390-A1 Production of arylophenones IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-03-30 EP disclosed
EP-0057503-A1 Production of hydroxy arylophenones IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-08-11 EP disclosed