SCHEMBL28354540

SCHEMBL28354540

CC(C(O)O)C(O)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.60
LMNA P02545 3/20 0.60
ADRA2C P18825 2/20 0.60
ADRA2A P08913 1/20 0.60
HIF1A Q16665 1/20 0.60
ALDH1A1 P00352 3/20 0.58
CHRM2 P08172 1/20 0.56
ADRA1A P35348 1/20 0.56
RGS12 O14924 1/20 0.56
GLA P06280 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
PKM P14618 1/20 0.56
ALOX15 P16050 1/20 0.56
TSHR P16473 1/20 0.56
ALOX12 P18054 1/20 0.56
NFKB1 P19838 1/20 0.56
HTR2A P28223 1/20 0.56
CYP2C19 P33261 1/20 0.56

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
SCHEMBL3096554 0.90 KDM4E (0.65) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL1071177 0.90 KDM4E (0.65) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL3096571 0.90 KDM4E (0.65) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL14962672 0.85 KDM4E (0.60) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL14543117 0.85 KDM4E (0.60) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL8294102 0.85 KDM4E (0.60) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL1080697 0.85 KDM4E (0.60) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL11637617 0.81 ADRA2C (0.75) KDM4ELMNAADRA2CADRA2AHIF1A
Acetic Acid SCHEMBL18759652 0.81 LMNA (0.56) KDM4ELMNAADRA2CADRA2AHIF1A
SCHEMBL6689612 0.79 KDM4E (0.65) KDM4ELMNAADRA2CADRA2AHIF1A

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
CN-110713577-B Expansion monomer modified light-cured resin and preparation method thereof 点铂医疗科技(常州)有限公司 2022-05-27 CN claimed
CN-110713577-A Expansion monomer modified light-cured resin and preparation method thereof 点铂医疗科技(常州)有限公司 2020-01-21 CN claimed
CN-110713577-B Expansion monomer modified light-cured resin and preparation method thereof 点铂医疗科技(常州)有限公司 2022-05-27 CN disclosed
CN-110713577-A Expansion monomer modified light-cured resin and preparation method thereof 点铂医疗科技(常州)有限公司 2020-01-21 CN disclosed