SCHEMBL28972904

SCHEMBL28972904

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

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 7/20 0.57
▸ MAOB P27338 4/20 0.51
▸ CALML3 P27482 2/20 0.51
▸ PTGS1 P23219 2/20 0.51
▸ SDHA P31040 2/20 0.51
▸ LMNA P02545 1/20 0.51
▸ CYP2C19 P33261 2/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2C9 P11712 1/20 0.43
▸ 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
SCHEMBL28972907 1.00 MAOA (0.57) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL30114797 0.95 MAOA (0.56) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL28972818 0.95 MAOA (0.56) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL28972823 0.95 MAOA (0.56) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL10259389 0.87 MAOA (0.63) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL28972775 0.86 CYP2C19 (0.65) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL30114874 0.86 CYP2C19 (0.65) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL28972773 0.86 CYP2C19 (0.65) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL30115023 0.84 MAOA (0.54) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL28972859 0.84 MAOA (0.54) MAOAMAOBCALML3PTGS1SDHA

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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