SCHEMBL7511216

SCHEMBL7511216

C=C(c1nccs1)c1nc2ccsc2c(=O)n1-c1ccccc1C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.47
POLB P06746 2/20 0.46
ALDH1A1 P00352 7/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 4/20 0.40
PDE4B Q07343 1/20 0.40
PDE7A Q13946 1/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
LMNA P02545 4/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 1/20 0.38
HSP90AA1 P07900 1/20 0.37
PLA2G7 Q13093 1/20 0.36
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35

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
SCHEMBL7518257 0.87 POLB (0.43) PIK3CDPOLBALDH1A1SMN1; SMN2MAPT
SCHEMBL7514703 0.84 ALDH1A1 (0.44) PIK3CDPOLBALDH1A1SMN1; SMN2MAPT
SCHEMBL7511753 0.83 PIK3CD (0.44) PIK3CDPOLBALDH1A1SMN1; SMN2MAPT
SCHEMBL7511488 0.83 PIK3CD (0.43) PIK3CDPOLBALDH1A1SMN1; SMN2MAPT
SCHEMBL7510642 0.83 POLB (0.46) PIK3CDPOLBALDH1A1SMN1; SMN2MAPT
SCHEMBL7520791 0.81 PIK3CD (0.42) PIK3CDPOLBALDH1A1SMN1; SMN2MAPT
SCHEMBL8805022 0.81 PDE7A (0.43) PIK3CDPOLBALDH1A1SMN1; SMN2MAPT
SCHEMBL7513112 0.81 PIK3CD (0.42) PIK3CDPOLBALDH1A1SMN1; SMN2MAPT
SCHEMBL8810900 0.79 PIK3CD (0.42) PIK3CDPOLBALDH1A1SMN1; SMN2MAPT
SCHEMBL6222959 0.77 ALDH1A1 (0.63) PIK3CDPOLBALDH1A1SMN1; SMN2MAPT

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-0807633-B1 Novel 2,3-disubstituted-(5,6)- heteroarylfused-pyrimidine-4-ones PFIZER (US) 2002-11-06 EP disclosed
EP-0807633-A2 Novel 2,3-disubstituted-(5,6)- heteroarylfused-pyrimidine-4-ones PFIZER INC. (US) 1997-11-19 EP disclosed