SCHEMBL28830482

SCHEMBL28830482

Cc1ccc(S(=O)(=O)n2ccc3c(NN4CC(OC(N)=O)C4)c([N+](=O)[O-])cnc32)cc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 4/20 0.33
HSD11B1 P28845 1/20 0.33
ALDH1A1 P00352 6/20 0.32
KMT2A Q03164 1/20 0.32
HTR6 P50406 1/20 0.32
LMNA P02545 2/20 0.32
MMP2 P08253 1/20 0.31
ANPEP P15144 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
ATM Q13315 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PKM P14618 1/20 0.31
MET P08581 1/20 0.31
EGFR P00533 1/20 0.31
ERBB2 P04626 1/20 0.31

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
SCHEMBL28830435 0.94 ALDH1A1 (0.33) L3MBTL1MAPTHSD11B1ALDH1A1KMT2A
SCHEMBL28830428 0.94 ALDH1A1 (0.33) L3MBTL1MAPTHSD11B1ALDH1A1KMT2A
SCHEMBL28830521 0.94 ALDH1A1 (0.33) L3MBTL1MAPTHSD11B1ALDH1A1KMT2A
SCHEMBL28950453 0.92 ALDH1A1 (0.34) L3MBTL1MAPTHSD11B1ALDH1A1LMNA
SCHEMBL28634279 0.87 L3MBTL1 (0.34) L3MBTL1MAPTHSD11B1ALDH1A1KMT2A
SCHEMBL30052184 0.85 L3MBTL1 (0.32) L3MBTL1MAPTHSD11B1ALDH1A1
SCHEMBL28830398 0.84 ALDH1A1 (0.33) L3MBTL1MAPTHSD11B1ALDH1A1KMT2A
SCHEMBL30052486 0.84 ALDH1A1 (0.32) L3MBTL1MAPTHSD11B1ALDH1A1RAB9A
SCHEMBL23120044 0.82 L3MBTL1 (0.37) L3MBTL1MAPTHSD11B1ALDH1A1KMT2A
SCHEMBL28830509 0.81 L3MBTL1 (0.35) L3MBTL1ALDH1A1KMT2AHTR6LMNA

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-110724142-B Amide or sulfonamide substituted hydrazine derivatives as JAK kinase inhibitors 启元生物(杭州)有限公司 2022-09-02 CN disclosed
CN-110724142-A Amide or sulfonamide substituted hydrazine derivatives as JAK kinase inhibitors 维眸生物科技(上海)有限公司 2020-01-24 CN disclosed