SCHEMBL7469203

SCHEMBL7469203

CC(=O)NCC1CC(c2cc(F)c(-n3ccnc3)c(F)c2)=NO1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MIF P14174 15/20 0.43
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CD38 P28907 1/20 0.35
RHOC P08134 1/20 0.34
RHOA P61586 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL7469864 0.90 RAB9A (0.40) MIFRAB9ANPC1SMN1; SMN2
SCHEMBL7472929 0.87 MIF (0.48) MIFRAB9ANPC1SMN1; SMN2
SCHEMBL7468177 0.82 PDE3B (0.45) MIFRAB9ANPC1SMN1; SMN2HDAC6
SCHEMBL7464403 0.81 MIF (0.53) MIFRAB9ANPC1SMN1; SMN2HDAC6
SCHEMBL7469138 0.80 MAOA (0.48) MIFRAB9AHDAC6
SCHEMBL7469769 0.79 MIF (0.44) MIFRAB9ANPC1SMN1; SMN2HDAC6
SCHEMBL7470351 0.77 MIF (0.60) MIFRAB9ANPC1SMN1; SMN2HDAC6
SCHEMBL7470274 0.77 MIF (0.52) MIFRAB9ANPC1SMN1; SMN2
SCHEMBL7467874 0.77 MIF (0.42) MIFRAB9ANPC1SMN1; SMN2HDAC6
SCHEMBL13298912 0.76 MIF (0.59) MIFRAB9ANPC1SMN1; SMN2HDAC6

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 8 patents. 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 claimed
EP-1054874-A1 SUBSTITUTED AMINOPHENYL ISOXAZOLINE DERIVATIVES USEFUL AS ANTIMICROBIALS PHARMACIA & UPJOHN COMPANY (US) 2000-11-29 EP claimed
US-6069141-A BACTERICIDES PHARMACIA & UPJOHN COMPANY (US) 2000-05-30 US claimed
WO-1999041244-A1 SUBSTITUTED AMINOPHENYL ISOXAZOLINE DERIVATIVES USEFUL AS ANTIMICROBIALS PHARMACIA & UPJOHN COMPANY (US) 1999-08-19 WO claimed
EP-1054874-B1 SUBSTITUTED AMINOPHENYL ISOXAZOLINE DERIVATIVES USEFUL AS ANTIMICROBIALS UPJOHN CO (US) 2002-08-28 EP disclosed
EP-1054874-A1 SUBSTITUTED AMINOPHENYL ISOXAZOLINE DERIVATIVES USEFUL AS ANTIMICROBIALS PHARMACIA & UPJOHN COMPANY (US) 2000-11-29 EP disclosed
US-6069141-A BACTERICIDES PHARMACIA & UPJOHN COMPANY (US) 2000-05-30 US disclosed
WO-1999041244-A1 SUBSTITUTED AMINOPHENYL ISOXAZOLINE DERIVATIVES USEFUL AS ANTIMICROBIALS PHARMACIA & UPJOHN COMPANY (US) 1999-08-19 WO disclosed