SCHEMBL25147126

SCHEMBL25147126

c1ccc(-c2nc(-c3ccccc3)c3c(n2)oc2cc4c(cc23)c2ccccc2n4-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.37
ATM Q13315 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 7/20 0.34
LMNA P02545 2/20 0.34
ALDH1A1 P00352 3/20 0.32
NPSR1 Q6W5P4 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
HTT P42858 2/20 0.32
HPGD P15428 2/20 0.31
POLB P06746 2/20 0.31
HSD17B10 Q99714 2/20 0.31
MAPK1 P28482 1/20 0.31
DUSP3 P51452 1/20 0.31
PTPN5 P54829 1/20 0.31

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
SCHEMBL25147129 1.00 L3MBTL1 (0.37) L3MBTL1ATMKDM4ESMN1; SMN2LMNA
SCHEMBL25147069 0.96 L3MBTL1 (0.40) L3MBTL1ATMKDM4ESMN1; SMN2LMNA
SCHEMBL25146974 0.94 SMN1; SMN2 (0.32) L3MBTL1ATMKDM4ESMN1; SMN2LMNA
SCHEMBL25146837 0.94 ATM (0.37) L3MBTL1ATMKDM4ESMN1; SMN2LMNA
SCHEMBL25146850 0.94 ATM (0.38) L3MBTL1ATMKDM4ESMN1; SMN2LMNA
SCHEMBL25146981 0.94 L3MBTL1 (0.35) L3MBTL1ATMKDM4ESMN1; SMN2LMNA
SCHEMBL24746546 0.93 L3MBTL1 (0.38) L3MBTL1ATMKDM4ESMN1; SMN2LMNA
SCHEMBL25146809 0.92 ATM (0.34) L3MBTL1ATMKDM4ESMN1; SMN2LMNA
SCHEMBL25147358 0.92 ATM (0.37) L3MBTL1ATMKDM4ESMN1; SMN2LMNA
SCHEMBL25146954 0.92 ATM (0.34) L3MBTL1ATMKDM4ESMN1; SMN2LMNA

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
WO-2023061998-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-04-20 WO disclosed