SCHEMBL11639673

SCHEMBL11639673

CNc1ncc(S(N)(=O)=O)cc1[N+](=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.49
CA1 P00915 5/20 0.49
CA2 P00918 5/20 0.49
CA9 Q16790 5/20 0.49
VCAM1 P19320 2/20 0.46
POLB P06746 4/20 0.45
GALR2 O43603 1/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 5/20 0.44
TDP1 Q9NUW8 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
PKM P14618 2/20 0.43
HTT P42858 1/20 0.42
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
DOT1L Q8TEK3 1/20 0.40

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
SCHEMBL11642150 0.85 MAPT (0.50) CA12CA1CA2CA9VCAM1
SCHEMBL11640285 0.80 MAPT (0.64) CA12CA1CA2CA9VCAM1
SCHEMBL11643842 0.78 CA2 (0.54) CA12CA1CA2CA9VCAM1
SCHEMBL1700421 0.76 VCAM1 (0.58) CA12CA1CA2CA9VCAM1
SCHEMBL11643613 0.76 CA1 (0.62) CA12CA1CA2CA9VCAM1
SCHEMBL11642131 0.76 CA2 (0.49) CA12CA1CA2CA9VCAM1
SCHEMBL6634074 0.76 ALDH1A1 (0.57) POLBGALR2LMNAMAPTTDP1
SCHEMBL2267794 0.76 POLB (0.51) POLBGALR2LMNAMAPTTDP1
SCHEMBL30807120 0.76 ALDH1A1 (0.57) POLBGALR2LMNAMAPTTDP1
SCHEMBL6832051 0.74 POLB (0.50) VCAM1POLBGALR2LMNAMAPT

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
US-4094982-A PYRIDINE SULFONAMIDES AND THEIR USE AS ANTICOCCIDIAL AGENTS SANKYO COMPANY LIMITED (JA) 1978-06-13 US claimed
US-4094982-A PYRIDINE SULFONAMIDES AND THEIR USE AS ANTICOCCIDIAL AGENTS SANKYO COMPANY LIMITED (JA) 1978-06-13 US disclosed