SCHEMBL8014349

SCHEMBL8014349

CC([O])OC(C)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
GAA P10253 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
LMNA P02545 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
CA4 P22748 1/20 0.37
CHRNB4 P30926 2/20 0.36
CHRNA3 P32297 2/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 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
SCHEMBL9296320 0.86 KDM4E (0.47) KDM4EMTNR1AMTNR1BGAACYP1A2
SCHEMBL14094031 0.82 KDM4E (0.44) KDM4EMTNR1AMTNR1BGAACYP1A2
SCHEMBL3161492 0.82 KDM4E (0.44) KDM4EMTNR1AMTNR1BGAACYP1A2
SCHEMBL57754 0.81 MTNR1A (0.46) KDM4EMTNR1AMTNR1BGAACYP1A2
SCHEMBL542873 0.81 KDM4E (0.50) KDM4EMTNR1AMTNR1BGAACYP1A2
Biphenyl SCHEMBL9770461 0.80 CYP1A2 (0.50) KDM4EMTNR1AMTNR1BGAACYP1A2
SCHEMBL11527810 0.79 LMNA (0.42) KDM4EMTNR1AMTNR1BGAACYP1A2
SCHEMBL11661695 0.78 KDM4E (0.42) KDM4EMTNR1AMTNR1BGAACYP1A2
SCHEMBL3169797 0.78 LMNA (0.45) KDM4EMTNR1AMTNR1BGAACYP1A2
SCHEMBL29167518 0.78 KDM4E (0.42) KDM4EMTNR1AMTNR1BGAACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6080833-A BIS(HYDROXYALKOXYLATED) 1,1'-SPIROBIINDAN POLYCARBONATES AND POLYESTERS POLYMERS AND CURABLE COMPOUNDS SUCH AS BIS(ACRYLATED ALKOXY)SPIROBIINDANS; ALSO POLYAMIDES AND POLYIMIDES CONTAINING SPIROBIINDAN GROUPS MITSUI CHEMICALS, INC. (JP) 2000-06-27 US disclosed
EP-0433024-B1 Colour recording medium containing leuco dye FUJI PHOTO FILM CO LTD (JP) 1994-09-21 EP disclosed
EP-0433024-A1 Colour recording medium containing leuco dye FUJI PHOTO FILM CO., LTD. (JP) 1991-06-19 EP disclosed