Nitrous Acid

Nitrous Acid

SCHEMBL28864182

O=C(O)c1ccnc(OCC(F)(F)F)c1.O=NO

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ EPHX2 P34913 1/20 0.52
▸ KDM4C Q9H3R0 7/20 0.42
▸ KDM5A P29375 3/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ KDM6B O15054 3/20 0.42
▸ KDM5C P41229 3/20 0.42
▸ KDM2A Q9Y2K7 3/20 0.42
▸ KDM3A Q9Y4C1 3/20 0.42
▸ KDM5B Q9UGL1 2/20 0.42
▸ KDM4A O75164 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ ALKBH5 Q6P6C2 2/20 0.42
▸ FTO Q9C0B1 2/20 0.42
▸ TET3 O43151 1/20 0.42
▸ BBOX1 O75936 1/20 0.42
▸ ASPH Q12797 1/20 0.42
▸ KDM4D Q6B0I6 1/20 0.42
▸ TET2 Q6N021 1/20 0.42

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
SCHEMBL796410 0.94 L3MBTL1 (0.60) L3MBTL1EPHX2KDM4CKDM5AKDM4E
SCHEMBL840626 0.82 L3MBTL1 (0.47) L3MBTL1EPHX2KDM4CKDM5AKDM4E
SCHEMBL28864180 0.82 EPHX2 (0.48) L3MBTL1EPHX2KDM4EALDH1A1MAPT
SCHEMBL2713663 0.81 EPHX2 (0.52) L3MBTL1EPHX2ALDH1A1MAPTPOLB
SCHEMBL30281370 0.81 EPHX2 (0.52) L3MBTL1EPHX2KDM5CKDM5BMAPT
SCHEMBL30403546 0.81 EPHX2 (0.52) L3MBTL1EPHX2ALDH1A1MAPTPOLB
SCHEMBL31191107 0.78 EPHX2 (0.53) L3MBTL1EPHX2KDM4EMAPTPOLB
SCHEMBL13875980 0.78 EPHX2 (0.50) L3MBTL1EPHX2KDM4EALDH1A1MAPT
SCHEMBL27913659 0.78 EPHX2 (0.50) L3MBTL1EPHX2KDM4EALDH1A1MAPT
SCHEMBL13890805 0.77 EPHX2 (0.52) L3MBTL1EPHX2KDM4CKDM4EMAPT

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-114901646-A Benzotriazine double oxide and pharmaceutical composition thereof 杭州瑞臻医药有限公司 2022-08-12 — — CN disclosed
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