SCHEMBL30453816

SCHEMBL30453816

COc1ccc(S(=O)(=O)Cc2cc(C)on2)cc1C1(N)N=C(Nc2ccc3c(C)n[nH]c3c2)C=CN1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.34

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
SCHEMBL30454256 0.82 MAPK8 (0.33)
SCHEMBL30453854 0.80 MAPK8 (0.31)
SCHEMBL30453940 0.79 MAPK8 (0.34)
SCHEMBL589718 0.75 METAP2 (0.37) METAP2
SCHEMBL31672509 0.74 KDR (0.41) METAP2
SCHEMBL10151182 0.74 KDR (0.41) METAP2
SCHEMBL12808485 0.71 KDM4E (0.36) METAP2
SCHEMBL30453669 0.66
SCHEMBL30453450 0.65 LRRK2 (0.34)
SCHEMBL30452600 0.65

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-113181362-B Medicament for preventing and/or treating amyotrophic lateral sclerosis 国立大学法人京都大学 2023-06-13 CN disclosed