SCHEMBL29965877

SCHEMBL29965877

NCc1ccc2cc(CCN3CC4(CCC4)C3)[nH]c2c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 8/20 0.51
METTL14 Q9HCE5 8/20 0.51
HRH3 Q9Y5N1 4/20 0.45
DRD1 P21728 2/20 0.43
DRD3 P35462 2/20 0.43
TMEM97 Q5BJF2 2/20 0.43
SIGMAR1 Q99720 2/20 0.43
CHRNA7 P36544 2/20 0.38
DRD4 P21917 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.34
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL23481976 1.00 METTL3 (0.51) METTL3METTL14HRH3DRD1DRD3
SCHEMBL23481977 0.83 HRH3 (0.62) METTL3METTL14HRH3SIGMAR1CHRNA7
SCHEMBL23482004 0.79 DRD3 (0.48) METTL3METTL14HRH3DRD1DRD3
SCHEMBL31519271 0.71 DRD3 (0.46) METTL3METTL14DRD1DRD3TMEM97
SCHEMBL29919205 0.71 METTL3 (0.50) METTL3METTL14DRD1DRD3TMEM97
SCHEMBL23458922 0.71 METTL3 (0.50) METTL3METTL14DRD1DRD3TMEM97
Lithium SCHEMBL29919186 0.70 METTL3 (0.49) METTL3METTL14DRD1DRD3TMEM97
SCHEMBL23482013 0.69 LOXL2 (0.46) LOXL2GAAPKM
SCHEMBL27792587 0.66 GAA (0.39) LOXL2GAAPKM
SCHEMBL25976935 0.63 METTL3 (0.55) METTL3METTL14

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-115151540-A Polyheterocyclic compounds as METTL3 inhibitors 风暴治疗有限公司 2022-10-04 CN disclosed