SCHEMBL7315148

SCHEMBL7315148

CCCc1nn(C)c(C(N)=O)c1NC(=O)Cc1ccc(CN2CCOCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.51
NPC1 O15118 1/20 0.49
HTT P42858 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TERT O14746 5/20 0.48
LMNA P02545 3/20 0.43
ADORA2A P29274 1/20 0.42
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
HRH3 Q9Y5N1 2/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
CCNC P24863 1/20 0.39
CDK8 P49336 1/20 0.39
CDK19 Q9BWU1 1/20 0.39
EPHX2 P34913 1/20 0.39
PARP1 P09874 1/20 0.39
PARP2 Q9UGN5 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
SCHEMBL7319178 0.82 TERT (0.54) NPC1HTTRAB9ASMN1; SMN2TERT
SCHEMBL7315114 0.82 TERT (0.54) NPC1HTTRAB9ASMN1; SMN2TERT
SCHEMBL7316154 0.79 TERT (0.52) NPC1HTTRAB9ASMN1; SMN2TERT
SCHEMBL7313692 0.79 TERT (0.52) SMN1; SMN2TERTLMNAPOLBL3MBTL1
SCHEMBL7305741 0.78 MAPK8 (0.49) RAB9ATERTADORA2A
SCHEMBL7308029 0.78 TERT (0.57) NPC1HTTRAB9ASMN1; SMN2TERT
SCHEMBL7311743 0.73 TERT (0.53) NPC1RAB9ASMN1; SMN2TERTLMNA
SCHEMBL15423767 0.71 TERT (0.58) SMN1; SMN2TERT
SCHEMBL7301563 0.71 TERT (0.61) HTTSMN1; SMN2TERTLMNAPOLB
SCHEMBL2477185 0.69 AOC3 (0.68) AOC3NPC1HTTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0911333-B1 Pyrazolo[4,3-d]pyrimidine derivatives and pharmaceutical compositions containing them PFIZER (US) 2002-04-10 EP disclosed
US-6235742-B1 CARDIOVASCULAR DISORDERS; ANTIALLERGENS PFIZER INC. 2001-05-22 US disclosed
EP-0911333-A1 Pyrazolo[4,3-d]pyrimidine derivatives and pharmaceutical compositions containing them PFIZER INC. (US) 1999-04-28 EP disclosed