SCHEMBL8404871

SCHEMBL8404871

O=C(O)COc1ccc2nc(O)nnc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 1/20 0.51
PDE2A O00408 1/20 0.48
PDE3B Q13370 1/20 0.48
PDE3A Q14432 1/20 0.48
P2RY12 Q9H244 1/20 0.48
MIF P14174 4/20 0.46
ALOX15 P16050 2/20 0.44
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MCL1 Q07820 1/20 0.44
LMNA P02545 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ACACA Q13085 1/20 0.42
PPARD Q03181 1/20 0.42
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
L3MBTL1 Q9Y468 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
SCHEMBL9616706 0.76 MIF (0.45) PDE2AMIFTSHRHSD17B10ALDH1A1
SCHEMBL4076964 0.74 PTPN7 (0.85) PTPN7PDE2APDE3BPDE3AP2RY12
SCHEMBL8399923 0.74 ALDH1A1 (0.56) PTPN7HSD17B10MCL1LMNAMEN1
SCHEMBL7978731 0.71 PTPN7 (0.66) PTPN7PDE2APDE3BPDE3AP2RY12
SCHEMBL2907678 0.71 PTPN7 (0.49) PTPN7PDE2APDE3BPDE3AP2RY12
SCHEMBL9714119 0.70 PTPN7 (0.71) PTPN7MIFALOX15TSHRHSD17B10
SCHEMBL7293656 0.70 TRIM24 (0.57) PTPN7PDE2APDE3BPDE3AP2RY12
SCHEMBL339492 0.70 ALOX15 (0.81) PTPN7ALOX15TSHRHSD17B10MCL1
SCHEMBL2909583 0.70 PTPN7 (0.48) PTPN7PDE2APDE3BPDE3AP2RY12
SCHEMBL4019934 0.70 PTPN7 (0.59) PTPN7ALOX15TSHRHSD17B10MCL1

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
US-5856325-A REDUCING INFLAMMATION BY INHIBITING PLA2 IN A MAMMAL BOEHRINGER MANNHEIM GMBH (DE) 1999-01-05 US disclosed
EP-0675881-B1 Use of benzotriazines as PLA2-Inhibitors and new benzotriazines BOEHRINGER MANNHEIM GMBH (DE) 1997-03-19 EP disclosed