SCHEMBL7095938

SCHEMBL7095938

Cc1nccn1-c1ccc(N)cc1F.Cc1nccn1-c1ccc(NC(=O)OCc2ccccc2)cc1F

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.47
BLK P51451 1/20 0.46
BTK Q06187 1/20 0.46
POLB P06746 1/20 0.43
MGLL Q99685 2/20 0.42
TP53 P04637 2/20 0.41
MAPT P10636 2/20 0.41
SCD O00767 3/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
RAB9A P51151 1/20 0.41
ATM Q13315 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NR3C2 P08235 1/20 0.39
ENPP2 Q13822 1/20 0.39

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
SCHEMBL5232610 0.94 PTGDR2 (0.51) PTGDR2POLBMGLLTP53MAPT
SCHEMBL8822065 0.93 PTGDR2 (0.46) PTGDR2BLKBTKPOLBMGLL
SCHEMBL8822060 0.82 POLB (0.48) PTGDR2BLKBTKPOLBMGLL
SCHEMBL7095231 0.82 PTGDR2 (0.47) PTGDR2BLKBTKPOLBMGLL
SCHEMBL4018737 0.81 PTGDR2 (0.45) PTGDR2POLBMGLLTP53MAPT
SCHEMBL7096187 0.81 CALML3 (0.44) PTGDR2SCD
SCHEMBL7841447 0.81 CALML3 (0.44) PTGDR2SCD
SCHEMBL7852375 0.81 CALML3 (0.44) PTGDR2SCD
SCHEMBL7082509 0.78 PTGDR2 (0.52) PTGDR2POLBMGLLTP53MAPT
SCHEMBL7840752 0.76 POLB (0.54) PTGDR2POLBMGLLTP53MAPT

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-1286998-A1 OXAZOLIDINONE DERIVATIVES WITH ANTIBIOTIC ACTIVITY AstraZeneca AB (SE) 2003-03-05 EP disclosed
WO-2001081350-A1 OXAZOLIDINONE DERIVATIVES WITH ANTIBIOTIC ACTIVITY ASTRAZENECA AB (SE) 2001-11-01 WO disclosed
EP-1121358-A1 HETEROCYCLYLAMINOMETHYLOXAZOLIDINONES AS ANTIBACTERIALS AstraZeneca AB (SE) 2001-08-08 EP disclosed
WO-2000021960-A1 HETEROCYCLYL AMINO METHYLOXA ZOLIDINONES AS ANTIBACTERIALS ASTRAZENECA AB (SE) 2000-04-20 WO disclosed