SCHEMBL8994507

SCHEMBL8994507

CC(C)(c1cc(O)ccc1-c1ccccc1)c1cc(O)ccc1-c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.59
ESR2 Q92731 6/20 0.58
BACE1 P56817 1/20 0.45
ESR1 P03372 7/20 0.44
ALDH1A1 P00352 2/20 0.44
NR1I2 O75469 1/20 0.44
LMNA P02545 1/20 0.44
CYP2C9 P11712 1/20 0.44
MIF P14174 1/20 0.44
TYR P14679 1/20 0.44
ALOX15 P16050 1/20 0.44
HTT P42858 1/20 0.44
NFE2L2 Q16236 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CYP3A4 P08684 1/20 0.44
HSP90AA1 P07900 1/20 0.42
MMP3 P08254 1/20 0.41
BCL2L1 Q07817 1/20 0.41
HSD17B1 P14061 2/20 0.41
CNR1 P21554 1/20 0.41

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
SCHEMBL30753562 0.89 ALOX5 (0.59) ALOX5ESR2BACE1ESR1ALDH1A1
SCHEMBL28526907 0.89 ALOX5 (0.59) ALOX5ESR2BACE1ESR1ALDH1A1
SCHEMBL9247179 0.86 ESR2 (0.56) ALOX5ESR2ESR1ALDH1A1NR1I2
SCHEMBL29978461 0.85 ALOX5 (0.53) ALOX5ESR2BACE1ESR1ALDH1A1
SCHEMBL674204 0.85 ALOX5 (0.53) ALOX5ESR2BACE1ESR1ALDH1A1
SCHEMBL1802128 0.81 ALOX5 (0.59) ALOX5ESR2BACE1ESR1HSP90AA1
Chloromethane SCHEMBL28112788 0.78 ALOX5 (0.87) ALOX5ESR2BACE1ESR1ALDH1A1
SCHEMBL28243339 0.76 ESR2 (0.62) ALOX5ESR2ESR1ALDH1A1LMNA
SCHEMBL7855632 0.76 HSD17B10 (0.57) ALOX5ESR2ESR1ALDH1A1NR1I2
SCHEMBL344517 0.76 ABL1 (0.50) ALOX5ESR2BACE1ESR1ALDH1A1

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-0604056-B1 Bis[4'-(4-hydroxyphenyl)-phenyl]alkanes and polycarbonates prepared therefrom GEN ELECTRIC (US) 1996-08-14 EP disclosed
EP-0604056-A2 Bis[4'-(4-hydroxyphenyl)-phenyl]alkanes and polycarbonates prepared therefrom GENERAL ELECTRIC COMPANY (US) 1994-06-29 EP disclosed
US-5319149-A Bis[4'-(4-hydroxyphenyl)-phenyl]alkanes and polycarbonates prepared therefrom GENERAL ELECTRIC COMPANY (US) 1994-06-07 US disclosed
US-5281689-A Polycarbonate from bis[4'-(4-hydroxyphenyl)-phenyl]alkanes GENERAL ELECTRIC COMPANY (US) 1994-01-25 US disclosed