SCHEMBL23255263

SCHEMBL23255263

N#C/C(C(=O)N1CCCCC1)=C(/O)c1cc(N)c(O)c(O)c1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 4/20 0.68
COMT P21964 3/20 0.63
KMT2A Q03164 4/20 0.39
GAA P10253 4/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.39
PKM P14618 1/20 0.39
MEN1 O00255 2/20 0.38
EGFR P00533 1/20 0.38
MAOB P27338 1/20 0.37
ALOX5 P09917 1/20 0.35
SERPINE1 P05121 1/20 0.35
HSD17B10 Q99714 1/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL23254889 0.96 COMT (0.67) FTOCOMTKMT2AGAAALDH1A1
SCHEMBL24386438 0.89 FTO (0.54) FTOCOMTKMT2AGAAALDH1A1
SCHEMBL23255166 0.88 FTO (0.53) FTOCOMTKMT2AGAAALDH1A1
SCHEMBL24386463 0.86 COMT (0.53) FTOCOMTKMT2AGAAALDH1A1
SCHEMBL24386389 0.83 FTO (0.65) FTOCOMTKMT2AGAAALDH1A1
SCHEMBL24386531 0.82 COMT (0.56) FTOCOMTKMT2AGAAALDH1A1
SCHEMBL29493687 0.81 FTO (1.00) FTOCOMT
SCHEMBL29493670 0.81 FTO (1.00) FTOCOMT
SCHEMBL20100869 0.81 FTO (1.00) FTOCOMT
SCHEMBL28717335 0.81 FTO (1.00) FTOCOMT

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
EP-3885337-A1 FTO INHIBITORS National Institute Of Biological Sciences, Beijing (CN) 2021-09-29 EP disclosed
EP-3303283-B1 FTO INHIBITORS NAT INSTITUTE OF BIOLOGICAL SCIENCES BEIJING (CN) 2021-04-21 EP disclosed