SCHEMBL13335252

SCHEMBL13335252

CC(=O)NC[C@H]1CN(c2ccc(-c3cccc(F)c3)cc2)C(=O)O1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 5/20 0.58
▸ MAOB P27338 2/20 0.58
▸ PTGS1 P23219 2/20 0.58
▸ SDHA P31040 2/20 0.58
▸ LMNA P02545 1/20 0.58
▸ CALML3 P27482 1/20 0.58
▸ F10 P00742 2/20 0.49
▸ GRM2 Q14416 1/20 0.47
▸ ABCB11 O95342 1/20 0.47
▸ CMA1 P23946 1/20 0.46

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
SCHEMBL3181071 0.88 MAOA (0.63) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5208261 0.88 MAOA (0.63) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9550299 0.88 MAOA (0.57) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9550276 0.88 MAOA (0.57) MAOAMAOBPTGS1SDHALMNA
SCHEMBL13298924 0.88 MAOA (0.61) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9550270 0.86 MAOA (0.52) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9823761 0.85 MAOA (0.65) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6753215 0.85 MAOA (0.51) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7106545 0.84 MAOA (0.62) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6755472 0.84 MAOA (0.50) MAOAMAOBPTGS1SDHALMNA

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
EP-1646629-B1 CYCLOPROPYL GROUP SUBSTITUTED OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF MERCK SHARP & DOHME (US) 2010-06-23 — — EP disclosed
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