SCHEMBL31333089

SCHEMBL31333089

NC(=O)c1cc(=O)n(Cc2ccccn2)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.51
CNOT7 Q9UIV1 1/20 0.46
KDM4E B2RXH2 6/20 0.46
ALDH1A1 P00352 7/20 0.43
HSD17B10 Q99714 2/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
PKM P14618 1/20 0.43
LMNA P02545 1/20 0.43
PARP10 Q53GL7 1/20 0.42
SIRT1 Q96EB6 1/20 0.41
HPGD P15428 1/20 0.41
GAA P10253 1/20 0.41
OPRM1 P35372 1/20 0.41
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

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
SCHEMBL31333065 0.78 CYP2C19 (0.40) KDM4EKMT2ALMNASIRT1
SCHEMBL31333071 0.77 CCNC (0.45) CNOT7KDM4EALDH1A1HSD17B10MEN1
SCHEMBL31333037 0.77 SMN1; SMN2 (0.51) ALDH1A1MEN1KMT2ALMNA
SCHEMBL31333075 0.77 MAPT (0.45) KDM4EALDH1A1PKMLMNAPARP10
SCHEMBL31333050 0.76 PKM (0.35) KDM4EALDH1A1MEN1KMT2APKM
SCHEMBL31333091 0.76 ADRA1D (0.51) ADRA1DCNOT7KDM4EALDH1A1HSD17B10
SCHEMBL31333084 0.75 CA5A (0.52) OPRM1HDAC1KDM4CMAPK1
Hydrochloric Acid SCHEMBL7991717 0.75 ADRA1D (0.48) ADRA1DCNOT7KDM4EALDH1A1HSD17B10
SCHEMBL31333059 0.74 PDE5A (0.47) ALDH1A1MEN1KMT2APKMLMNA
SCHEMBL31333017 0.73 TP53 (0.45) MEN1KMT2ALMNAPARP10HPGD

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