Nitrous Acid

Nitrous Acid

SCHEMBL29134658

O=C(O)c1ccnc(-c2ccc(F)cc2)c1.O=NO

nearest known ligand 0.57

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 12/20 0.57
KDM5B Q9UGL1 6/20 0.57
KDM4A O75164 6/20 0.57
KDM5A P29375 5/20 0.57
KMO O15229 1/20 0.56
KDM2B Q8NHM5 1/20 0.52
KDM5C P41229 5/20 0.50
KDM4E B2RXH2 4/20 0.50
KDM2A Q9Y2K7 4/20 0.50
KDM3A Q9Y4C1 4/20 0.50
KDM6B O15054 3/20 0.50
P4HA1 P13674 1/20 0.49
LOXL2 Q9Y4K0 1/20 0.48
BCL2L1 Q07817 1/20 0.47
BAD Q92934 1/20 0.47
KDM4B O94953 1/20 0.47
JMJD6 Q6NYC1 1/20 0.46
TET3 O43151 1/20 0.45
BBOX1 O75936 1/20 0.45
ALDH1A1 P00352 1/20 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
SCHEMBL1517490 0.94 KDM4C (0.63) KDM4CKDM5BKDM4AKDM5AKMO
SCHEMBL30638242 0.94 KDM4C (0.63) KDM4CKDM5BKDM4AKDM5AKMO
Nitrous Acid SCHEMBL28651257 0.86 KDM4C (0.63) KDM4CKDM5BKDM4AKDM5AKMO
Nitrous Acid SCHEMBL29134645 0.85 KDM4C (0.59) KDM4CKDM5BKDM4AKDM5AKMO
Nitrous Acid SCHEMBL29134647 0.81 KDM4C (0.61) KDM4CKDM5BKDM4AKDM5AKMO
SCHEMBL28856057 0.80 MAP4K4 (0.54) KDM4CKDM5BKDM4AKDM5AKMO
SCHEMBL22506619 0.80 KMO (0.49) KDM4CKDM5BKDM4AKDM5AKMO
SCHEMBL15104963 0.80 KDM4C (0.51) KDM4CKDM5BKDM4AKDM5AKMO
SCHEMBL29134657 0.79 KMT2A (0.46) KDM4CKDM5BKDM4AKDM5AKMO
SCHEMBL648273 0.79 KDM4C (0.71) KDM4CKDM5BKDM4AKDM5AKMO

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-117343002-A Synthesis method of beta-cyanoalkyl pyridine compound 西南医科大学 2024-01-05 CN disclosed