SCHEMBL28678908

SCHEMBL28678908

O=C(O)c1cccc([Si](c2cccc(C(=O)O)c2)(c2cccc(C(=O)O)c2)c2cccc(C(=O)O)c2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA6 P23280 1/20 0.56
CA9 Q16790 1/20 0.56
KMO O15229 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52
HPGD P15428 1/20 0.52
HSD17B10 Q99714 1/20 0.52
DAO P14920 1/20 0.50
TSHR P16473 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
UNG P13051 1/20 0.50
FOLH1 Q04609 1/20 0.48
AKR1C3 P42330 1/20 0.48
TP53 P04637 1/20 0.47
RHOA P61586 1/20 0.46
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46

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
SCHEMBL10476991 0.96 KMO (0.53) CA12CA1CA2CA6CA9
SCHEMBL10476987 0.83 KDM4E (0.56) HPGDTSHRAKR1C3TP53
SCHEMBL8018938 0.83 ACHE (0.62) CA12CA1CA2CA6CA9
SCHEMBL10029692 0.83 ATM (0.61) CA1CA2HPGDHSD17B10
SCHEMBL14740775 0.81 CA12 (0.50) CA12CA1CA2CA6CA9
Hydrochloric Acid SCHEMBL10926742 0.81 ACHE (0.61) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL28756611 0.80 CA12 (0.71) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL20500514 0.80 CA12 (0.71) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL22462 0.80 CA12 (0.71) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL28462260 0.80 CA12 (0.71) CA12CA1CA2CA6CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114790585-B Method for preparing MOFs nano-enzyme in situ through electrostatic spinning and glucose colorimetric sensor thereof 扬州大学 2023-11-24 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-114790585-B Method for preparing MOFs nano-enzyme in situ through electrostatic spinning and glucose colorimetric sensor thereof 扬州大学 2023-11-24 CN disclosed
CN-114011384-B Film for removing heavy metal ions in water and performing fluorescence detection and preparation method thereof 浙江大学 2023-03-24 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-114011384-A Film for removing heavy metal ions in water and performing fluorescence detection and preparation method thereof 浙江大学 2022-02-08 CN disclosed