SCHEMBL31419952

SCHEMBL31419952

COc1ccc(COc2ccc3c(c2)C(=O)C(=O)N3C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.50
PARK7 Q99497 1/20 0.50
GRM5 P41594 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
CASP3 P42574 5/20 0.47
TDP1 Q9NUW8 1/20 0.46
APP P05067 3/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAOB P27338 1/20 0.43

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
SCHEMBL31419926 0.89 MAPT (0.52) GRM5CASP3TDP1MEN1KMT2A
SCHEMBL31419928 0.88 MAOB (0.54) CHRM5GRM5CASP3MAOB
SCHEMBL31419925 0.88 MAOB (0.54) CHRM5GRM5CASP3MAOB
SCHEMBL31419935 0.88 MAOB (0.54) GRM5CA12CA1CA2CA9
SCHEMBL29289495 0.88 PARK7 (0.54) PARK7GRM5CASP3MEN1KMT2A
SCHEMBL31419920 0.88 PARK7 (0.54) PARK7GRM5CASP3MEN1KMT2A
SCHEMBL31419915 0.85 CASP3 (0.46) CHRM5PARK7CA12CA1CA2
SCHEMBL30704878 0.84 CASP3 (0.59) CHRM5PARK7CASP3
SCHEMBL2551295 0.84 CASP3 (0.59) CHRM5PARK7CASP3
SCHEMBL31419957 0.81 MAOB (0.54) CHRM5GRM5TDP1MEN1KMT2A

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-119350241-A Quinolinone derivative and preparation method and application thereof 浙江工业大学 2025-01-24 CN disclosed