SCHEMBL7805633

SCHEMBL7805633

O=C(Nc1cccc(F)c1N1CCC(NC(=O)C(F)(F)F)C1)OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.46
CTSB P07858 1/20 0.46
CTSK P43235 1/20 0.46
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
TGM2 P21980 7/20 0.41
ELANE P08246 3/20 0.41
HSD11B1 P28845 1/20 0.41
F13A1 P00488 3/20 0.39
TGM1 P22735 3/20 0.39
CHRM3 P20309 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
DRD4 P21917 1/20 0.39
VCP P55072 1/20 0.39
TGM6 O95932 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL7805632 0.81 TGM2 (0.46) CTSLCTSBCTSKNPC1RAB9A
SCHEMBL7815379 0.71 NPC1 (0.42) NPC1RAB9AELANECHRM3
SCHEMBL9231451 0.71 NPC1 (0.42) NPC1RAB9AELANECHRM3
SCHEMBL9231450 0.71 NPC1 (0.42) NPC1RAB9AELANECHRM3
SCHEMBL31481320 0.69 SMN1; SMN2 (0.50) NPC1RAB9ATGM2ELANEHSD11B1
SCHEMBL4510870 0.68 CTSK (0.46) CTSLCTSBCTSKHSD11B1ALDH1A1
SCHEMBL4510873 0.68 CTSK (0.46) CTSLCTSBCTSKHSD11B1ALDH1A1
SCHEMBL4390012 0.68 DRD4 (0.65) CHRM3DRD4
SCHEMBL6865672 0.68 DRD4 (0.65) CHRM3DRD4
SCHEMBL2412607 0.67 CTSL (0.53) CTSLCTSBCTSKTGM2HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0788498-B1 PHENYLOXAZOLIDINONE ANTIMICROBIALS UPJOHN CO (US) 2001-08-16 EP disclosed
US-5883093-A TREATING MICROBIAL INFECTIONS IN WARM BLOODED ANIMALS, INCLUDING HUMANS PHARMACIA & UPJOHN COMPANY (US) 1999-03-16 US disclosed
EP-0788498-A1 PHENYLOXAZOLIDINONE ANTIMICROBIALS PHARMACIA & UPJOHN COMPANY (US) 1997-08-13 EP disclosed
WO-1996013502-A1 PHENYLOXAZOLIDINONE ANTIMICROBIALS PHARMACIA & UPJOHN COMPANY (US) 1996-05-09 WO disclosed