SCHEMBL8528345

SCHEMBL8528345

[CH2]c1cccc(Cn2c(=O)n(-c3ccccc3)n(-c3ccccc3)c2=O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RGS4 P49798 5/20 0.43
RGS8 P57771 5/20 0.43
MAPK8 P45983 2/20 0.40
MAPK9 P45984 2/20 0.40
PGR P06401 1/20 0.40
MAPT P10636 2/20 0.40
GSK3A P49840 3/20 0.40
GSK3B P49841 3/20 0.40
KMT2A Q03164 1/20 0.39
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
KDM4E B2RXH2 1/20 0.37
PKM P14618 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CCNB2 O95067 1/20 0.37
CDK1 P06493 1/20 0.37
CCNB1 P14635 1/20 0.37
CCNB3 Q8WWL7 1/20 0.37
SRC P12931 1/20 0.37
P2RX4 Q99571 1/20 0.37

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
SCHEMBL8529611 0.81 RGS4 (0.58) RGS4RGS8MAPTKMT2AHPGD
SCHEMBL8119500 0.81 PRMT6 (0.46) RGS4RGS8MAPK8MAPK9PGR
SCHEMBL8126612 0.77 FEN1 (0.52) MAPTL3MBTL1
SCHEMBL8126895 0.75 RGS4 (0.46) RGS4RGS8MAPK8MAPK9PGR
SCHEMBL11131835 0.70 NPC1 (0.43) MAPTCYP3A4HPGD
SCHEMBL8985073 0.68 GSK3B (0.67) RGS4RGS8MAPTGSK3AGSK3B
SCHEMBL9271953 0.67 PGR (0.50) MAPK8PGRMAPTGSK3AGSK3B
SCHEMBL393865 0.67 MAOA (0.56) HPGD
SCHEMBL1287433 0.67 CALM1 (0.57)
SCHEMBL8526739 0.65 CNR1 (0.61) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5807875-A OBESITY THERAPY DR. KARL THOMAE GMBH (DE) 1998-09-15 US disclosed