SCHEMBL25263447

SCHEMBL25263447

O=C(OC(=O)N1C(=O)CCC1=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.50
F2 P00734 1/20 0.45
LMNA P02545 1/20 0.45
MAPK1 P28482 2/20 0.43
TSHR P16473 2/20 0.42
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 2/20 0.39
MGLL Q99685 1/20 0.39
NPC1 O15118 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
HIF1A Q16665 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38

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
SCHEMBL4066802 0.76 KMT2A (0.48) KMT2AF2LMNAMAPK1TSHR
SCHEMBL14363762 0.76 GLA (0.31) MGLLPOLB
SCHEMBL669626 0.75 KMT2A (0.54) KMT2ARAB9ANPC1ALDH1A1
SCHEMBL28771494 0.75 KMT2A (0.47) KMT2AF2LMNAMAPK1TSHR
SCHEMBL9608993 0.74 BCHE (0.53) KMT2ALMNAMAPK1TSHRSMN1; SMN2
SCHEMBL19309377 0.74 KMT2A (0.53) KMT2AF2LMNAMAPK1TSHR
SCHEMBL133554 0.74 KMT2A (0.53) KMT2AF2LMNAMAPK1TSHR
Hydrogen Peroxide SCHEMBL27952375 0.73 LMNA (0.70) KMT2AF2LMNAMAPK1TSHR
SCHEMBL52413 0.73 LMNA (0.70) KMT2AF2LMNAMAPK1TSHR
Benzene SCHEMBL27793442 0.73 LMNA (0.70) KMT2AF2LMNAMAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023104209-A1 METTL3 INHIBITOR COMPOUND 上海昂阔医药有限公司 2023-06-15 WO disclosed
WO-2023030385-A1 PYRIMIDINE-FUSED CYCLIC COMPOUND AND PREPARATION METHOD AND USE THEREOF 劲方医药科技(上海)有限公司 2023-03-09 WO disclosed