SCHEMBL7463499

SCHEMBL7463499

CC(=S)NCC1CC(c2cc(F)c(N3CCOCC3)c(F)c2)=NO1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.52
NPC1 O15118 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MIF P14174 10/20 0.40
PDE3B Q13370 4/20 0.40
PDE3A Q14432 4/20 0.40
MAOB P27338 2/20 0.40
LMNA P02545 1/20 0.40
MAOA P21397 1/20 0.40
PTGS1 P23219 1/20 0.40
CALML3 P27482 1/20 0.40
SDHA P31040 1/20 0.40
HDAC6 Q9UBN7 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL7469138 0.90 MAOA (0.48) RAB9AMIFPDE3BPDE3AMAOB
SCHEMBL7468825 0.80 MAOB (0.59) RAB9ANPC1MIFPDE3BPDE3A
SCHEMBL14345346 0.80 MAOB (0.59) RAB9ANPC1MIFPDE3BPDE3A
SCHEMBL7469864 0.80 RAB9A (0.40) RAB9ANPC1SMN1; SMN2MIF
SCHEMBL7477204 0.79 MIF (0.54) RAB9ANPC1SMN1; SMN2MIF
SCHEMBL7469769 0.78 MIF (0.44) RAB9ANPC1SMN1; SMN2MIFMAOB
SCHEMBL7474027 0.78 MAOA (0.48) RAB9ANPC1SMN1; SMN2MIFMAOB
SCHEMBL7478325 0.76 RAB9A (0.45) RAB9ANPC1SMN1; SMN2MIFMAOB
SCHEMBL7467874 0.76 MIF (0.42) RAB9ANPC1SMN1; SMN2MIFMAOB
SCHEMBL7471632 0.75 MIF (0.47) RAB9ANPC1SMN1; SMN2MIF

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 6 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
US-6069141-A BACTERICIDES PHARMACIA & UPJOHN COMPANY (US) 2000-05-30 US 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