SCHEMBL31499282

SCHEMBL31499282

CC(C)c1ccc(C(=O)O)c2nccnc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 2/20 0.45
L3MBTL1 Q9Y468 4/20 0.40
KDM4E B2RXH2 4/20 0.40
ALDH1A1 P00352 4/20 0.40
KDM4A O75164 2/20 0.40
EGLN1 Q9GZT9 2/20 0.40
KDM4C Q9H3R0 2/20 0.40
KDM6B O15054 1/20 0.40
KDM6A O15550 1/20 0.40
TET3 O43151 1/20 0.40
KDM4B O94953 1/20 0.40
KDM5C P41229 1/20 0.40
KDM4D Q6B0I6 1/20 0.40
TET2 Q6N021 1/20 0.40
ALKBH5 Q6P6C2 1/20 0.40
TET1 Q8NFU7 1/20 0.40
FTO Q9C0B1 1/20 0.40
KDM2A Q9Y2K7 1/20 0.40
KDM3A Q9Y4C1 1/20 0.40
SLC40A1 Q9NP59 1/20 0.38

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
SCHEMBL12032781 0.80 SLC40A1 (0.37) L3MBTL1KDM4ESLC40A1RAB9ANPC1
SCHEMBL23809253 0.80 KDM4E (0.54) ACE2L3MBTL1KDM4EALDH1A1KDM4A
SCHEMBL26551421 0.80 KDM4E (0.62) ACE2L3MBTL1KDM4EALDH1A1KDM4A
SCHEMBL19034481 0.77 ACE2 (0.44) ACE2KDM4EALDH1A1RAB9AMEN1
SCHEMBL31499279 0.76 KDM4E (0.43) L3MBTL1KDM4EALDH1A1KDM4AEGLN1
SCHEMBL28512682 0.74 KDM4E (0.57) L3MBTL1KDM4EALDH1A1KDM4AEGLN1
SCHEMBL23809130 0.73 KDM4E (0.50) ACE2L3MBTL1KDM4EALDH1A1KDM4A
SCHEMBL23809372 0.73 L3MBTL1 (0.62) ACE2L3MBTL1KDM4EKDM4AEGLN1
SCHEMBL31499283 0.73 GABRP (0.42) L3MBTL1KDM4EALDH1A1KDM4AEGLN1
SCHEMBL31499272 0.72 KDM6B (0.38) L3MBTL1KDM4EALDH1A1KDM4AEGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119504843-A Quinoxaline-5-carboxylic acid coordinated catalyst, composite catalyst, preparation method and application 上海元革新材料科技有限公司 2025-02-25 CN claimed
CN-119504843-A Quinoxaline-5-carboxylic acid coordinated catalyst, composite catalyst, preparation method and application 上海元革新材料科技有限公司 2025-02-25 CN disclosed