SCHEMBL28375588

SCHEMBL28375588

O=C(O)c1cc(C(=O)O)cc(-c2cccc3cc4ccccc4cc23)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP1A2 P05177 1/20 0.46
GLA P06280 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
HSD17B10 Q99714 1/20 0.46
DHODH Q02127 2/20 0.45
GAA P10253 1/20 0.45
KMO O15229 1/20 0.44
MCL1 Q07820 1/20 0.44
ACMSD Q8TDX5 1/20 0.44
PTPN1 P18031 1/20 0.44
CTRC Q99895 1/20 0.42
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SOS1 Q07889 1/20 0.40

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
SCHEMBL28380975 0.89 KMO (0.56) KMOMCL1ACMSDPTPN1SERPINE1
SCHEMBL28376135 0.87 HDAC8 (0.50) KDM4EALDH1A1MEN1KMT2ACYP1A2
SCHEMBL27675911 0.87 KMO (0.49) KDM4EALDH1A1MEN1KMT2ACYP1A2
SCHEMBL2589690 0.81 MCL1 (0.56) KDM4EALDH1A1MEN1KMT2ACYP1A2
SCHEMBL16488681 0.80 DHODH (0.53) KDM4EALDH1A1MEN1KMT2ACYP1A2
SCHEMBL29908924 0.80 DHODH (0.57) KMT2ADHODHKMO
SCHEMBL30332794 0.78 TNF (0.50) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL29908910 0.78 DHODH (0.55) KMT2ADHODHKMO
SCHEMBL60347 0.78 TNF (0.50) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL27880686 0.78 MAP4K4 (0.50) KDM4EALDH1A1MEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118325115-A Metal organic framework material with photo-thermal conversion performance, preparation method and application 宁波大学 2024-07-12 CN claimed
CN-114790585-A Method for preparing MOFs nano enzyme in situ by electrostatic spinning and glucose colorimetric sensor thereof 扬州大学 2022-07-26 CN claimed
CN-114685803-A Coreactant embedded electrochemical luminescence double-ligand infinite coordination polymer nano particle and preparation method and application thereof 山东师范大学 2022-07-01 CN claimed
CN-110845740-B Cyclodextrin metal framework circular polarization luminescent crystal and preparation method and application thereof 中国科学院化学研究所 2022-02-08 CN claimed
CN-110845740-A Cyclodextrin metal framework circular polarization luminescent crystal and preparation method and application thereof 中国科学院化学研究所 2020-02-28 CN claimed
CN-118325115-A Metal organic framework material with photo-thermal conversion performance, preparation method and application 宁波大学 2024-07-12 CN disclosed
CN-114790585-A Method for preparing MOFs nano enzyme in situ by electrostatic spinning and glucose colorimetric sensor thereof 扬州大学 2022-07-26 CN disclosed
CN-114685803-A Coreactant embedded electrochemical luminescence double-ligand infinite coordination polymer nano particle and preparation method and application thereof 山东师范大学 2022-07-01 CN disclosed
CN-114685803-A Coreactant embedded electrochemical luminescence double-ligand infinite coordination polymer nano particle and preparation method and application thereof 山东师范大学 2022-07-01 CN disclosed
CN-110845740-B Cyclodextrin metal framework circular polarization luminescent crystal and preparation method and application thereof 中国科学院化学研究所 2022-02-08 CN disclosed
CN-110845740-A Cyclodextrin metal framework circular polarization luminescent crystal and preparation method and application thereof 中国科学院化学研究所 2020-02-28 CN disclosed