Nitrogen

Nitrogen

SCHEMBL28754258

Cc1ccc2nc(-c3ccc(N)cc3)sc2c1S(=O)(=O)O.N#N

nearest known ligand 0.95

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.95
ALDH1A1 P00352 4/20 0.95
SMN1; SMN2 Q16637 4/20 0.95
GLA P06280 3/20 0.95
HPGD P15428 3/20 0.95
TP53 P04637 3/20 0.95
RECQL P46063 2/20 0.95
TDP1 Q9NUW8 2/20 0.95
HSD17B10 Q99714 2/20 0.95
CYP3A4 P08684 1/20 0.95
NT5E P21589 1/20 0.95
CASP1 P29466 1/20 0.95
CASP7 P55210 1/20 0.95
APP P05067 9/20 0.53
MAPT P10636 7/20 0.53
SNCA P37840 1/20 0.53
KDM4E B2RXH2 4/20 0.48
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
POLB P06746 2/20 0.45

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
SCHEMBL633557 0.97 GAA (1.00) GAAALDH1A1SMN1; SMN2GLAHPGD
SCHEMBL15939945 0.92 GAA (0.88) GAAALDH1A1SMN1; SMN2GLAHPGD
SCHEMBL10605029 0.91 GAA (0.86) GAAALDH1A1SMN1; SMN2GLAHPGD
SCHEMBL14768668 0.91 GAA (0.86) GAAALDH1A1SMN1; SMN2GLAHPGD
SCHEMBL15940004 0.91 GAA (0.86) GAAALDH1A1SMN1; SMN2GLAHPGD
SCHEMBL5578358 0.91 GAA (0.86) GAAALDH1A1SMN1; SMN2GLAHPGD
SCHEMBL15093377 0.90 GAA (0.84) GAAALDH1A1SMN1; SMN2GLAHPGD
SCHEMBL9612305 0.87 GAA (0.81) GAAALDH1A1SMN1; SMN2GLAHPGD
SCHEMBL14768734 0.85 ALDH1A1 (0.76) GAAALDH1A1SMN1; SMN2GLAHPGD
SCHEMBL1456224 0.85 GAA (0.77) GAAALDH1A1SMN1; SMN2GLAHPGD

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
CN-114634719-A Surface-modified pigments and their use 沈阳化工研究院有限公司 2022-06-17 CN disclosed