SCHEMBL27601595

SCHEMBL27601595

CCN(Cc1ccco1)c1ccc(Cl)[n+]([O-])c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.44
CNR2 P34972 3/20 0.44
HPGD P15428 4/20 0.37
ALDH1A1 P00352 7/20 0.36
MAPT P10636 7/20 0.36
MEN1 O00255 6/20 0.36
KMT2A Q03164 6/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
RECQL P46063 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 2/20 0.36
NPC1 O15118 1/20 0.36
NFKB1 P19838 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
TSHR P16473 2/20 0.36
GAA P10253 1/20 0.36
POLB P06746 2/20 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
SCHEMBL4061503 0.75 BACE1 (0.39) CNR1CNR2HPGDALDH1A1MAPT
SCHEMBL8634675 0.74 TSHR (0.56) CNR1CNR2HPGDALDH1A1MAPT
SCHEMBL1642904 0.64 HTT (0.50) HPGDALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL2806112 0.64 HTT (0.50) HPGDALDH1A1MAPTSMN1; SMN2KDM4E
Ammonia Solution, Strong SCHEMBL23877941 0.63 HTT (0.49) HPGDALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL10241255 0.63 RIPK1 (0.50) ALDH1A1KDM4EPOLBHTTTHRB
SCHEMBL1498696 0.62 GAA (0.50) CNR1CNR2ALDH1A1MAPTSMN1; SMN2
SCHEMBL3218735 0.62 CACNA1B (0.58) HPGDALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL13698663 0.62 RIPK1 (0.45) CNR1CNR2HPGDALDH1A1MAPT
SCHEMBL12911312 0.61 CA2 (0.42) ALDH1A1MEN1KMT2ASMN1; SMN2TDP1

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
CN-100519550-C 2-oxoindole compounds having inhibitory activity on glycogen synthase kinase 3 receptor ASTRAZENECA AB SE (SE) 2009-07-29 CN disclosed
CN-1923812-A New compounds ASTRAZENECA AB (SE) 2007-03-07 CN disclosed
CN-1642938-A Novel compounds ASTRAZENECA AB (SE) 2005-07-20 CN disclosed