SCHEMBL31333091

SCHEMBL31333091

NC(=O)c1cc(=O)n(Cc2cccnc2)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.51
CNOT7 Q9UIV1 1/20 0.48
KDM4E B2RXH2 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 1/20 0.45
RECQL P46063 1/20 0.43
OPRM1 P35372 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
HSD17B13 Q7Z5P4 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PKM P14618 1/20 0.42
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41

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
SCHEMBL31333071 0.83 CCNC (0.45) CNOT7KDM4EL3MBTL1HSD17B13HSD17B10
SCHEMBL31333025 0.79 ALDH1A1 (0.51) ADRA1DKDM4EPOLBRECQLSMN1; SMN2
SCHEMBL31333022 0.79 ROCK2 (0.44) SMN1; SMN2HSD17B13CYP11B1MMP13ALDH1A1
SCHEMBL31333078 0.77 GRM2 (0.47) KDM4ESMN1; SMN2LMNAHTTPKM
SCHEMBL31333017 0.77 TP53 (0.45) L3MBTL1SMN1; SMN2LMNAHTTHDAC3
Hydrochloric Acid SCHEMBL7988910 0.76 ADRA1D (0.48) ADRA1DCNOT7KDM4EL3MBTL1POLB
SCHEMBL31333074 0.76 TP53 (0.53) ADRA1DSMN1; SMN2LMNAPKMALDH1A1
SCHEMBL31333086 0.76 ATM (0.51) KDM4ESMN1; SMN2HSD17B13LMNAALDH1A1
SCHEMBL31333089 0.76 ADRA1D (0.51) ADRA1DCNOT7KDM4EOPRM1LMNA
SCHEMBL5305967 0.75 PPARG (0.62) ADRA1DOPRM1HSD17B13HDAC1HDAC6

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-119320386-A METTL3 inhibitor, preparation method and application thereof 郑州大学第一附属医院 2025-01-17 CN disclosed