SCHEMBL6511520

SCHEMBL6511520

CCCNC(=O)c1cc(Br)c([N+](=O)[O-])s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
L3MBTL1 Q9Y468 2/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
GFER P55789 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
RAB9A P51151 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
RXFP1 Q9HBX9 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
KMT2A Q03164 1/20 0.38
LMNA P02545 2/20 0.38
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALOX15 P16050 1/20 0.38

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
SCHEMBL6511156 0.93 POLB (0.51) POLBUSP2KDM4EMAPTRAB9A
SCHEMBL6513961 0.82 USP2 (0.54) POLBL3MBTL1USP2ALDH1A1KDM4E
SCHEMBL6510754 0.79 ACKR3 (0.52) POLBL3MBTL1ALDH1A1HPGDRAB9A
SCHEMBL6511511 0.78 POLB (0.54) POLBL3MBTL1USP2ALDH1A1KDM4E
SCHEMBL5840709 0.76 PTPN2 (0.39) POLBL3MBTL1ALDH1A1KDM4EHPGD
SCHEMBL6508901 0.75 DAO (0.38) ALDH1A1KDM4EMAPTKMT2A
SCHEMBL6979866 0.74 SMN1; SMN2 (0.58) POLBL3MBTL1ALDH1A1MAPTATG4B
SCHEMBL6362085 0.69 GAA (0.75) POLBL3MBTL1ALDH1A1KDM4EMAPT
SCHEMBL12208079 0.68 HTT (0.35) POLBUSP2ALDH1A1MAPTHPGD
SCHEMBL10024469 0.68 GAA (0.60) POLBL3MBTL1ALDH1A1MAPTHPGD

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-2005082899-A1 OXAZOLIDINONE DERIVATIVES AS ANTIMICROBIALS RANBAXY LABORATORIES LIMITED (IN) 2005-09-09 WO disclosed