SCHEMBL30003080

SCHEMBL30003080

Cc1ccc2c(c1)C(=O)C(Cl)=C(N)C2=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 1/20 0.60
NSD2 O96028 1/20 0.60
HK1 P19367 1/20 0.60
PAX8 Q06710 1/20 0.60
MAOA P21397 1/20 0.57
MAOB P27338 1/20 0.57
ELANE P08246 1/20 0.55
ALKBH3 Q96Q83 2/20 0.45
LCK P06239 1/20 0.42
S100A4 P26447 1/20 0.41
ADORA2A P29274 1/20 0.41
MEN1 O00255 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
KMT2A Q03164 2/20 0.40
MITF O75030 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
NQO1 P15559 3/20 0.40
POR P16435 3/20 0.40

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
SCHEMBL7812173 1.00 TDP2 (0.60) TDP2NSD2HK1PAX8MAOA
SCHEMBL7812020 1.00 TDP2 (0.60) TDP2NSD2HK1PAX8MAOA
SCHEMBL9643596 0.86 MAOA (0.68) MAOAMAOBELANEALKBH3LCK
SCHEMBL30002985 0.86 MAOA (0.68) MAOAMAOBELANEALKBH3LCK
SCHEMBL7818893 0.81 TDP2 (0.64) TDP2NSD2HK1PAX8S100A4
SCHEMBL30003548 0.81 TDP2 (0.64) TDP2NSD2HK1PAX8S100A4
SCHEMBL7819127 0.81 TDP2 (0.64) TDP2NSD2HK1PAX8S100A4
SCHEMBL9628207 0.81 MAOA (0.73) MAOAMAOBELANEALKBH3LCK
SCHEMBL23271912 0.80 TDP2 (0.53) TDP2NSD2HK1PAX8MAOA
SCHEMBL30003154 0.80 TDP2 (0.53) TDP2NSD2HK1PAX8MAOA

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
CN-110891980-B Radical polymerization control agent and radical polymerization control method 川崎化成工业株式会社 2022-09-30 CN disclosed