SCHEMBL30811710

SCHEMBL30811710

CN(C)c1cncc(C(N)=O)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.70
▸ MEN1 O00255 1/20 0.70
▸ ALDH1A1 P00352 1/20 0.70
▸ KMT2A Q03164 1/20 0.70
▸ MKNK1 Q9BUB5 5/20 0.44
▸ MKNK2 Q9HBH9 5/20 0.44
▸ RAF1 P04049 1/20 0.42
▸ PKMYT1 Q99640 1/20 0.42
▸ SIRT2 Q8IXJ6 5/20 0.42
▸ SIRT1 Q96EB6 5/20 0.42
▸ SIRT3 Q9NTG7 5/20 0.42
▸ F7 P08709 1/20 0.41
▸ F3 P13726 1/20 0.41
▸ SARM1 Q6SZW1 1/20 0.41
▸ SIRT6 Q8N6T7 1/20 0.41
▸ SIRT5 Q9NXA8 1/20 0.41
▸ SIRT4 Q9Y6E7 1/20 0.41
▸ CYP11B1 P15538 1/20 0.41
▸ CYP11B2 P19099 1/20 0.41
▸ FYN P06241 1/20 0.39

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
Hydrochloric Acid SCHEMBL30811690 0.98 KDM4E (0.68) KDM4EMEN1ALDH1A1KMT2AMKNK1
SCHEMBL30811844 0.82 ALDH1A1 (1.00) KDM4EMEN1ALDH1A1KMT2AMKNK1
SCHEMBL2841794 0.79 SIRT2 (0.54) KDM4EMEN1ALDH1A1KMT2AMKNK1
SCHEMBL3509627 0.78 ALDH1A1 (0.66) KDM4EMEN1ALDH1A1KMT2ACYP11B1
SCHEMBL28505725 0.77 ALDH1A1 (0.64) KDM4EMEN1ALDH1A1KMT2AHDAC1
SCHEMBL28333029 0.74 CYP2C19 (0.64) KDM4EMEN1ALDH1A1KMT2ASIRT2
SCHEMBL832732 0.74 HCAR2 (0.67) KDM4EMEN1ALDH1A1KMT2AMKNK1
SCHEMBL4477190 0.74 MKNK1 (0.66) KDM4EMEN1ALDH1A1KMT2AMKNK1
SCHEMBL29503159 0.74 HCAR2 (0.67) KDM4EMEN1ALDH1A1KMT2AMKNK1
SCHEMBL9607829 0.73 SMYD3 (0.52) KDM4EMKNK1MKNK2RAF1PKMYT1

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
WO-2024056099-A1 METTL3 INHIBITOR COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 北京华益健康药物研究中心 2024-03-21 — — WO disclosed
CN-117720533-A MetTL3 inhibitor compound and pharmaceutical composition and application thereof 北京华益健康药物研究中心 2024-03-19 — — CN disclosed
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