SCHEMBL16685757

SCHEMBL16685757

Cc1cc(Br)ccc1N1C[C@H](CI)OC1=O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
F10 P00742 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
HBB P68871 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TSHR P16473 1/20 0.40
P2RX7 Q99572 1/20 0.38
GRM2 Q14416 7/20 0.38
HTR7 P34969 1/20 0.37

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
SCHEMBL16685760 1.00 MAOA (0.40) MAOAMAOBF10MEN1MAPT
SCHEMBL16686255 0.86 MAOA (0.55) MAOAMAOBF10MEN1MAPT
SCHEMBL16686258 0.86 MAOA (0.55) MAOAMAOBF10MEN1MAPT
SCHEMBL16686174 0.85 GRM2 (0.44) MAOAMAOBF10GRM2
SCHEMBL16686176 0.85 GRM2 (0.44) MAOAMAOBF10GRM2
SCHEMBL28922753 0.80 GRM2 (0.49) MAOAMAOBMAPTGRM2
SCHEMBL16696395 0.79 GRM2 (0.39) MAOAMAOBF10GRM2
SCHEMBL16686237 0.79 GRM2 (0.50) F10GRM2
SCHEMBL16686236 0.79 GRM2 (0.50) F10GRM2
SCHEMBL16685839 0.76 F10 (0.36) MAOAMAOBF10GRM2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015066413-A1 OXAZOLIDINONE HYDROXAMIC ACID COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS NOVARTIS AG (CH) 2015-05-07 WO disclosed
WO-2015066413-A1 OXAZOLIDINONE HYDROXAMIC ACID COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS NOVARTIS AG (CH) 2015-05-07 WO disclosed