SCHEMBL25307454

SCHEMBL25307454

COC(=O)c1cn(-c2ccc(OC)cc2)c2ccccc12

nearest known ligand 0.79

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.79
KMT2A Q03164 6/20 0.64
LMNA P02545 4/20 0.57
KDM4E B2RXH2 2/20 0.57
ALDH1A1 P00352 2/20 0.57
MEN1 O00255 3/20 0.56
GAA P10253 2/20 0.55
THRB P10828 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.51
TP53 P04637 3/20 0.51
MAPT P10636 2/20 0.51
TSHR P16473 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL408819 0.88 NR4A2 (1.00) NR4A2KMT2ALMNAKDM4EALDH1A1
SCHEMBL12918558 0.87 NR4A2 (0.63) NR4A2KMT2ALMNAKDM4EALDH1A1
SCHEMBL12386984 0.86 NR4A2 (0.58) NR4A2KMT2ALMNATP53MAPT
SCHEMBL19407224 0.86 NR4A2 (0.79) NR4A2KMT2ALMNAKDM4EALDH1A1
SCHEMBL25238096 0.84 NR4A2 (0.75) NR4A2KMT2ALMNAKDM4EALDH1A1
SCHEMBL28241207 0.84 NR4A2 (0.56) NR4A2KMT2ALMNAALDH1A1TP53
SCHEMBL15420904 0.83 NR4A2 (0.79) NR4A2KMT2ALMNAKDM4EALDH1A1
SCHEMBL25305334 0.80 NR4A2 (0.51) NR4A2KMT2ALMNATP53MAPT
SCHEMBL17782624 0.80 NR4A2 (0.61) NR4A2KMT2ALMNAKDM4EALDH1A1
SCHEMBL15557161 0.80 NR4A2 (0.72) NR4A2KMT2ALMNAKDM4EALDH1A1

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
EP-4460492-A1 COMPOUNDS CONTAINING A HYDROXYPHENYL MOIETY AND THEIR USE (INSERM) Institut National de la Santé et de la Recherche Médicale (FR) 2024-11-13 EP disclosed
WO-2023131677-A1 COMPOUNDS CONTAINING A HYDROXYPHENYL MOIETY AND THEIR USE INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2023-07-13 WO disclosed