SCHEMBL30800092

SCHEMBL30800092

O=C(O)c1cc(-c2ccnc(C(=O)O)c2)ccn1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 5/20 0.71
KDM4E B2RXH2 6/20 0.68
ALDH1A1 P00352 3/20 0.68
KDM5A P29375 2/20 0.68
KDM3A Q9Y4C1 2/20 0.68
KDM6B O15054 1/20 0.68
TET3 O43151 1/20 0.68
KDM4A O75164 1/20 0.68
BBOX1 O75936 1/20 0.68
MAPT P10636 1/20 0.68
KDM5C P41229 1/20 0.68
ASPH Q12797 1/20 0.68
KDM4D Q6B0I6 1/20 0.68
TET2 Q6N021 1/20 0.68
ALKBH5 Q6P6C2 1/20 0.68
KDM7A Q6ZMT4 1/20 0.68
KDM8 Q8N371 1/20 0.68
TET1 Q8NFU7 1/20 0.68
EGLN2 Q96KS0 1/20 0.68
FTO Q9C0B1 1/20 0.68

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
SCHEMBL7513922 1.00 KMO (0.71) KMOKDM4EALDH1A1KDM5AKDM3A
SCHEMBL16673126 0.91 KMO (0.62) KMOKDM4EALDH1A1KDM5AKDM3A
SCHEMBL725162 0.91 KMO (0.62) KMOKDM4EALDH1A1KDM5AKDM3A
SCHEMBL28284992 0.88 KDM4E (0.66) KMOKDM4EALDH1A1KDM5AKDM3A
SCHEMBL22828994 0.87 KDM4E (0.64) KMOKDM4EALDH1A1KDM5AKDM3A
SCHEMBL24572141 0.86 KMO (0.62) KMOKDM4EALDH1A1KDM5AKDM3A
SCHEMBL3223512 0.86 KMO (0.62) KMOKDM4EALDH1A1KDM5AKDM3A
SCHEMBL1938975 0.86 KMO (0.67) KMOKDM4EALDH1A1KDM5AKDM3A
SCHEMBL25174367 0.86 KMO (0.72) KMOKDM4EALDH1A1KDM5AKDM3A
SCHEMBL3391178 0.84 KMO (0.60) KMOKDM4EALDH1A1KDM5AKDM3A

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
CN-118344602-A Lewis acidity regulation and control method based on MOF single-atom catalyst and application of catalyst 安徽大学 2024-07-16 CN claimed
CN-117712439-A Oxidative reduction organic flow battery for energy storage and application thereof 宿迁时代储能科技有限公司 2024-03-15 CN claimed
CN-117712439-A Oxidative reduction organic flow battery for energy storage and application thereof 宿迁时代储能科技有限公司 2024-03-15 CN disclosed