SCHEMBL29951706

SCHEMBL29951706

CCc1nn(Cc2ccccc2)c(Cl)c1C=O

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
MEN1 O00255 2/20 0.47
ALDH1A1 P00352 6/20 0.46
LMNA P02545 4/20 0.46
NPSR1 Q6W5P4 2/20 0.46
KDM4E B2RXH2 3/20 0.44
HTT P42858 1/20 0.44
MAPT P10636 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
PTGDR2 Q9Y5Y4 2/20 0.40
HPGD P15428 2/20 0.40
TDP1 Q9NUW8 1/20 0.39
PDE5A O76074 1/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL29958109 0.89 KMT2A (0.45) KMT2AMEN1ALDH1A1LMNANPSR1
SCHEMBL29956315 0.87 SMN1; SMN2 (0.41) KMT2AMEN1ALDH1A1LMNANPSR1
SCHEMBL3317542 0.85 PTGDR2 (0.48) KMT2AMEN1ALDH1A1LMNANPSR1
SCHEMBL29951365 0.85 KMT2A (0.44) KMT2AMEN1ALDH1A1LMNANPSR1
SCHEMBL964648 0.82 KMT2A (0.60) KMT2AMEN1ALDH1A1LMNANPSR1
SCHEMBL29953734 0.79
SCHEMBL29950809 0.78 KMT2A (0.46) KMT2AMEN1ALDH1A1LMNANPSR1
SCHEMBL29951177 0.78 KMT2A (0.46) KMT2AMEN1ALDH1A1LMNANPSR1
SCHEMBL29953708 0.78 SMN1; SMN2 (0.47) KMT2AMEN1ALDH1A1LMNANPSR1
SCHEMBL6417130 0.78 ALDH1A1 (0.52) KMT2AMEN1ALDH1A1LMNANPSR1

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed