SCHEMBL7095231

SCHEMBL7095231

Cc1cn(-c2ccc(N)cc2F)cn1.Cc1cn(-c2ccc(NC(=O)OCc3ccccc3)cc2F)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.47
BLK P51451 1/20 0.46
BTK Q06187 1/20 0.46
SCD O00767 3/20 0.43
MGLL Q99685 2/20 0.42
PSEN1 P49768 2/20 0.42
PSEN2 P49810 2/20 0.42
APH1B Q8WW43 2/20 0.42
NCSTN Q92542 2/20 0.42
APH1A Q96BI3 2/20 0.42
PSENEN Q9NZ42 2/20 0.42
TP53 P04637 2/20 0.41
MAPT P10636 2/20 0.41
POLB P06746 1/20 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

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
SCHEMBL5235675 0.94 PTGDR2 (0.51) PTGDR2SCDMGLLPSEN1PSEN2
SCHEMBL8822060 0.84 POLB (0.48) PTGDR2BLKBTKSCDMGLL
SCHEMBL7095938 0.82 PTGDR2 (0.47) PTGDR2BLKBTKSCDMGLL
SCHEMBL8822065 0.81 PTGDR2 (0.46) PTGDR2BLKBTKSCDMGLL
SCHEMBL4018735 0.81 PTGDR2 (0.45) PTGDR2SCDMGLLTP53MAPT
SCHEMBL7853448 0.81 CALML3 (0.43) PTGDR2SCD
SCHEMBL7853449 0.81 CALML3 (0.43) PTGDR2SCD
SCHEMBL13054805 0.79 SCD (0.44) PTGDR2SCDMGLLTP53MAPT
SCHEMBL7839750 0.78 MGLL (0.54) PTGDR2SCDMGLLTP53MAPT
SCHEMBL7841588 0.78 POLB (0.54) PTGDR2SCDMGLLTP53MAPT

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 2 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