SCHEMBL9035476

SCHEMBL9035476

CCCCC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.61
MAPT P10636 7/20 0.61
SMN1; SMN2 Q16637 6/20 0.61
L3MBTL1 Q9Y468 5/20 0.61
TDP1 Q9NUW8 4/20 0.61
MAPK1 P28482 4/20 0.61
ALDH1A1 P00352 6/20 0.60
POLB P06746 1/20 0.58
GAA P10253 5/20 0.58
KMT2A Q03164 1/20 0.58
HPGD P15428 1/20 0.57

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
SCHEMBL8854725 0.85 ALDH1A1 (0.59) MAPTSMN1; SMN2ALDH1A1GAAKMT2A
SCHEMBL9225175 0.82 LMNA (0.67) LMNAMAPTSMN1; SMN2L3MBTL1TDP1
SCHEMBL9230302 0.81 ALDH1A1 (0.57) MAPTSMN1; SMN2ALDH1A1POLBGAA
SCHEMBL7574965 0.80 MAPT (0.51) LMNAMAPTSMN1; SMN2MAPK1ALDH1A1
SCHEMBL12388226 0.77 MAPT (0.56) LMNAMAPTSMN1; SMN2TDP1ALDH1A1
SCHEMBL8396995 0.74 NPC1 (0.72) LMNAMAPTSMN1; SMN2MAPK1ALDH1A1
SCHEMBL2552295 0.74 LMNA (0.82) LMNAMAPTSMN1; SMN2L3MBTL1TDP1
Morpholine SCHEMBL7574967 0.74 HCAR3 (0.55) MAPTKMT2A
SCHEMBL9231190 0.74 MAPT (0.56) LMNAMAPTSMN1; SMN2L3MBTL1TDP1
SCHEMBL7568813 0.72 HCAR3 (0.69) MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0696583-A1 Benzimidazolesulfonamide derivatives and pharmaceutical composition Kureha Chemical Industry Co., Ltd. (JP) 1996-02-14 EP disclosed