SCHEMBL6795146

SCHEMBL6795146

COc1ccc(-n2c(=O)n(O)c(=O)c3cc(F)c(N4CCC(NC(=O)OC(C)(C)C)C4)cc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.41
PIM3 Q86V86 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
F10 P00742 1/20 0.40
SUV39H2 Q9H5I1 11/20 0.39
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
PIK3CA P42336 1/20 0.37
MTOR P42345 1/20 0.37
PRKDC P78527 1/20 0.37
HSD17B10 Q99714 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
OGFRL1 Q5TC84 1/20 0.36

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
SCHEMBL6799992 0.93 PIM1 (0.42) PIM1PIM3PIM2F10SUV39H2
SCHEMBL6801118 0.92 MTNR1A (0.45) PIM1PIM3PIM2F10SUV39H2
SCHEMBL6802963 0.86 PIM1 (0.40) PIM1PIM3PIM2F10SUV39H2
SCHEMBL6798617 0.82 PRKD3 (0.44) PIM1PIM3PIK3CAHSD17B10OPRD1
Hydrochloric Acid SCHEMBL7007125 0.81 PRKD3 (0.43) PIM1PIM3PIK3CAHSD17B10OPRD1
SCHEMBL6801982 0.80 THRB (0.42) PIK3CA
SCHEMBL6797213 0.80 MTNR1A (0.42) PIM1PIM3PIM2F10MTNR1A
SCHEMBL6801123 0.79 PIM1 (0.41) PIM1PIM3PIM2F10OPRM1
SCHEMBL6800837 0.79 TRPV4 (0.48) HSD17B10
SCHEMBL4510547 0.76 PIM1 (0.42) PIM1PIM3PIM2F10PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6825199-B2 7-Substituted quinazolin-2,4-diones useful as antibacterial agents WARNER-LAMBERT COMPANY 2004-11-30 US disclosed
EP-1028950-B1 7-SUBSTITUTED QUINAZOLIN-2,4-DIONES USEFUL AS ANTIBACTERIAL AGENTS WARNER LAMBERT CO (US) 2003-05-02 EP disclosed
US-6331538-B1 TREATMENT OF BACTERIAL INFECTION WARNER-LAMBERT COMPANY 2001-12-18 US disclosed
EP-1028950-A1 NOVEL 7-SUBSTITUTED QUINAZOLIN-2,4-DIONES USEFUL AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 2000-08-23 EP disclosed
WO-1999021840-A1 NOVEL 7-SUBSTITUTED QUINAZOLIN-2,4-DIONES USEFUL AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1999-05-06 WO disclosed