SCHEMBL30115023

SCHEMBL30115023

CC(=O)NC[C@H]1CN(c2ccc(-c3ccc(CC=NNC(=N)N)cn3)c(F)c2)C(=O)O1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 6/20 0.54
▸ CALML3 P27482 4/20 0.49
▸ MAOB P27338 3/20 0.49
▸ PTGS1 P23219 2/20 0.49
▸ SDHA P31040 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ F10 P00742 1/20 0.43

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
SCHEMBL28972859 1.00 MAOA (0.54) MAOACALML3MAOBPTGS1SDHA
SCHEMBL28972823 0.90 MAOA (0.56) MAOACALML3MAOBPTGS1SDHA
SCHEMBL28972818 0.90 MAOA (0.56) MAOACALML3MAOBPTGS1SDHA
SCHEMBL30114797 0.90 MAOA (0.56) MAOACALML3MAOBPTGS1SDHA
SCHEMBL28972868 0.87 MAOA (0.55) MAOACALML3MAOBPTGS1SDHA
SCHEMBL10258876 0.86 MAOA (0.62) MAOACALML3MAOBPTGS1SDHA
SCHEMBL10259391 0.85 MAOA (0.63) MAOACALML3MAOBPTGS1SDHA
SCHEMBL28972907 0.84 MAOA (0.57) MAOACALML3MAOBPTGS1SDHA
SCHEMBL28972904 0.84 MAOA (0.57) MAOACALML3MAOBPTGS1SDHA
SCHEMBL18459789 0.82 MAOA (0.54) MAOACALML3MAOBPTGS1SDHA

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-115677679-A Oxazolidinone compound containing biaryl hydrazone structure and preparation method and application thereof 沈阳药科大学 2023-02-03 — — CN disclosed
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