SCHEMBL4752727

SCHEMBL4752727

CC(=O)NCC1CN(c2ccc(-c3csc(Cc4nnn[nH]4)n3)c(F)c2)C(=O)O1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 5/20 0.57
▸ MAOB P27338 2/20 0.51
▸ PTGS1 P23219 2/20 0.50
▸ SDHA P31040 2/20 0.50
▸ CALML3 P27482 2/20 0.50
▸ LMNA P02545 1/20 0.50
▸ F10 P00742 4/20 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
SCHEMBL4816551 0.92 MAOA (0.48) MAOAMAOBPTGS1SDHACALML3
SCHEMBL4750476 0.87 MAOA (0.58) MAOAMAOBPTGS1SDHACALML3
SCHEMBL1393586 0.85 MAOA (0.60) MAOAMAOBPTGS1SDHACALML3
SCHEMBL8600419 0.84 MAOA (0.68) MAOAMAOBPTGS1SDHACALML3
SCHEMBL4003430 0.82 MAOA (0.65) MAOAMAOBPTGS1SDHACALML3
SCHEMBL13054632 0.82 MAOA (0.57) MAOAMAOBPTGS1SDHACALML3
SCHEMBL3745841 0.82 MAOA (0.57) MAOAMAOBPTGS1SDHACALML3
SCHEMBL3762420 0.81 MAOA (0.57) MAOAMAOBPTGS1SDHACALML3
SCHEMBL13054622 0.81 MAOA (0.57) MAOAMAOBPTGS1SDHACALML3
SCHEMBL3764724 0.81 MAOA (0.57) MAOAMAOBPTGS1SDHACALML3

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
WO-2008143649-A2 NOVEL OXAZOLIDINONE COMPOUNDS AS ANTIINFECTIVE AGENTS DR. REDDY'S LABORATORIES LIMITED (IN) 2008-11-27 — — WO disclosed
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