SCHEMBL7475327

SCHEMBL7475327

CC(=O)NC1ON=C(c2ccc(-n3cccc3)c(F)c2)C1C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.33
CNR2 P34972 4/20 0.33
MIF P14174 2/20 0.33
PDE3B Q13370 3/20 0.32
PDE3A Q14432 3/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.31
SMPD3 Q9NY59 3/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL7471554 0.85 GRIA1 (0.32) MIF
SCHEMBL7476122 0.84 MIF (0.38) MIF
SCHEMBL7475038 0.81 MIF (0.34) MIFPDE3BPDE3AMEN1KMT2A
SCHEMBL7471004 0.78 MIF (0.31) MIFPDE3BPDE3A
SCHEMBL7470274 0.69 MIF (0.52) MIFLMNA
SCHEMBL7471632 0.64 MIF (0.47) MIF
SCHEMBL8065082 0.63 CCR1 (0.32) CNR1CNR2LMNAMEN1KMT2A
SCHEMBL7531253 0.61 PDE3B (0.37) PDE3BPDE3A
SCHEMBL9042286 0.57 ALDH1A1 (0.39) TSHRLMNAKDM4E
SCHEMBL172523 0.57 ALDH1A1 (0.41) CNR1CNR2LMNAKDM4E

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-1054874-B1 SUBSTITUTED AMINOPHENYL ISOXAZOLINE DERIVATIVES USEFUL AS ANTIMICROBIALS UPJOHN CO (US) 2002-08-28 EP disclosed