SCHEMBL8489333

SCHEMBL8489333

CC(=O)NC[C@H]1CN(c2cc(F)c(-c3ccncc3)c(F)c2)C(=O)O1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.60
MAOB P27338 4/20 0.60
CALML3 P27482 2/20 0.60
PTGS1 P23219 2/20 0.60
SDHA P31040 2/20 0.60
LMNA P02545 1/20 0.60
F10 P00742 2/20 0.47

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
SCHEMBL7947008 1.00 MAOA (0.60) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL7945894 0.90 MAOA (0.62) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL7945913 0.88 MAOA (0.60) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL7944580 0.88 MAOA (0.56) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL6302773 0.88 CALML3 (0.74) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL6302777 0.88 CALML3 (0.74) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL7945901 0.88 MAOA (0.50) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL7945900 0.87 MAOA (0.50) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL16562024 0.87 MAOA (0.59) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL7949629 0.87 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
WO-1999033839-A1 CEPHEM DERIVATIVES AND A METHOD FOR PRODUCING THE COMPOUNDS AND AN ANTIBACTERIAL COMPOSITION CONTAINING THE COMPOUNDS CHEIL JEDANG CORPORATION (KR) 1999-07-08 WO disclosed