SCHEMBL7600523

SCHEMBL7600523

C=CCC1(CC=C)CCc2cc(O)ccc2O1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.46
ESR2 Q92731 7/20 0.36
ESR1 P03372 6/20 0.36
NR3C1 P04150 2/20 0.36
PGR P06401 1/20 0.36
OPRM1 P35372 3/20 0.35
OPRD1 P41143 3/20 0.35
OPRK1 P41145 3/20 0.35
ENTPD5 O75356 2/20 0.34
CETP P11597 1/20 0.34
PTPN1 P18031 1/20 0.34
MGAM O43451 2/20 0.33
GAA P10253 2/20 0.33
SI P14410 2/20 0.33
MGAM2 Q2M2H8 2/20 0.33
MAPT P10636 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
SCHEMBL4563229 0.93 AKT1 (0.43) AKT1ESR2ESR1NR3C1PGR
SCHEMBL5846302 0.83 AKT1 (0.60) AKT1ESR2ESR1NR3C1PGR
SCHEMBL547117 0.78 SIGMAR1 (0.42)
SCHEMBL7787622 0.74 AKT1 (0.51) AKT1ESR2ESR1ENTPD5CETP
SCHEMBL10824418 0.72 ESR2 (0.38) AKT1ESR2ESR1NR3C1PGR
SCHEMBL4475359 0.71 AKT1 (0.49) AKT1ESR2ESR1ENTPD5CETP
SCHEMBL3184205 0.71 AKT1 (0.56) AKT1ESR2ESR1ENTPD5CETP
SCHEMBL30513267 0.71 AKT1 (0.56) AKT1ESR2ESR1ENTPD5CETP
SCHEMBL6130742 0.70 AKT1 (0.42) AKT1ESR2ESR1OPRM1ENTPD5
SCHEMBL11705856 0.70 AKT1 (0.55) AKT1ESR2ESR1ENTPD5CETP

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-1232210-A1 USE OF PHTHALIDES IN STABILISER MIXTURES FOR ORGANIC MATERIALS Clariant Finance (BVI) Limited (VG) 2002-08-21 EP disclosed
WO-2001032762-A1 USE OF PHTHALIDES IN STABILISER MIXTURES FOR ORGANIC MATERIALS CLARIANT FINANCE (BVI) LIMITED (VG) 2001-05-10 WO disclosed