SCHEMBL28946161

SCHEMBL28946161

COCCNc1nc(S(C)(=O)=O)ccc1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.48
MAPT P10636 6/20 0.44
ALDH1A1 P00352 2/20 0.44
HCAR3 P49019 1/20 0.43
PTGER4 P35408 1/20 0.40
RAB9A P51151 1/20 0.40
POLB P06746 3/20 0.39
TXNRD1 Q16881 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
PKM P14618 1/20 0.38
FBP1 P09467 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
MAPK8 P45983 1/20 0.36
MAPK9 P45984 1/20 0.36
MAPK10 P53779 1/20 0.36

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
SCHEMBL28307336 0.93 KDM4E (0.42) LMNAMAPTALDH1A1POLBMEN1
SCHEMBL28946158 0.88 L3MBTL1 (0.38) LMNAMAPTALDH1A1PTGER4RAB9A
SCHEMBL28964122 0.85 L3MBTL1 (0.44) LMNAMAPTALDH1A1HCAR3RAB9A
SCHEMBL28946165 0.83 L3MBTL1 (0.54) LMNAMAPTALDH1A1HCAR3POLB
SCHEMBL28946177 0.82 PGK1 (0.46) LMNAMAPTALDH1A1HCAR3POLB
SCHEMBL28946162 0.81 MAPT (0.48) LMNAMAPTALDH1A1RAB9ATXNRD1
SCHEMBL8246245 0.80 MAPT (0.59) LMNAMAPTALDH1A1HCAR3PTGER4
SCHEMBL28946146 0.80 NPC1 (0.58) LMNAMAPTRAB9ATXNRD1KMT2A
SCHEMBL28946150 0.79 PKM (0.46) LMNAMAPTALDH1A1RAB9APOLB
SCHEMBL28946147 0.78 MAPT (0.46) LMNAMAPTRAB9APOLBTXNRD1

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-109970633-B Pyridine sulfone and derivative, preparation method and application thereof 湖南化工研究院有限公司 2022-12-27 CN claimed
CN-109970633-B Pyridine sulfone and derivative, preparation method and application thereof 湖南化工研究院有限公司 2022-12-27 CN disclosed