SCHEMBL29646595

SCHEMBL29646595

O=C(O)c1cccn2c(=O)c3cc4ccccc4cc3nc12

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.75
CASP1 P29466 1/20 0.75
CASP7 P55210 1/20 0.75
HSD17B10 Q99714 1/20 0.75
MAPT P10636 3/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
ALDH1A1 P00352 1/20 0.67
POLR1A O95602 16/20 0.65
ECE1 P42892 1/20 0.62
MUS81 Q96NY9 1/20 0.62
NPSR1 Q6W5P4 2/20 0.61
LMNA P02545 1/20 0.61
PKM P14618 1/20 0.61
HTT P42858 1/20 0.61
POLB P06746 1/20 0.60
RECQL P46063 1/20 0.60
BLM P54132 1/20 0.60
TDP1 Q9NUW8 1/20 0.60

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
SCHEMBL17099654 1.00 KDM4E (0.75) KDM4ECASP1CASP7HSD17B10MAPT
SCHEMBL25761771 0.88 POLR1A (0.67) KDM4EMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL17117513 0.88 POLR1A (0.64) KDM4ECASP1CASP7HSD17B10MAPT
SCHEMBL18631335 0.86 KDM4E (1.00) KDM4ECASP1CASP7HSD17B10MAPT
SCHEMBL21798989 0.84 KDM4E (0.71) KDM4ECASP1CASP7HSD17B10MAPT
SCHEMBL29649777 0.84 KDM4E (0.71) KDM4ECASP1CASP7HSD17B10MAPT
SCHEMBL21798961 0.84 KDM4E (0.71) KDM4ECASP1CASP7HSD17B10MAPT
SCHEMBL21798898 0.83 KDM4E (0.69) KDM4ECASP1CASP7HSD17B10MAPT
SCHEMBL21798922 0.83 KDM4E (0.69) KDM4ECASP1CASP7HSD17B10MAPT
SCHEMBL21798938 0.83 KDM4E (0.69) KDM4ECASP1CASP7HSD17B10MAPT

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-2022060816-A1 COMPOUNDS WHICH INHIBIT RNA POLYMERASE THE JOHNS HOPKINS UNIVERSITY (US) 2022-03-24 WO disclosed