SCHEMBL8368953

SCHEMBL8368953

O=C1C=C(Nc2ccccc2)C(=O)c2nc(-c3ccccn3)c(-c3ccccn3)nc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.59
KMT2A Q03164 5/20 0.59
MAPT P10636 4/20 0.59
MEN1 O00255 4/20 0.59
TDP1 Q9NUW8 3/20 0.59
ALDH1A1 P00352 2/20 0.59
GUCY1B2 O75343 1/20 0.59
GUCY1A2 P33402 1/20 0.59
GUCY1A1 Q02108 1/20 0.59
GUCY1B1 Q02153 1/20 0.59
CDK4 P11802 2/20 0.49
HTT P42858 4/20 0.47
LMNA P02545 3/20 0.47
NPC1 O15118 3/20 0.47
NPSR1 Q6W5P4 3/20 0.47
RAB9A P51151 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
NFKB1 P19838 2/20 0.47
NFKB2 Q00653 2/20 0.47
RELA Q04206 2/20 0.47

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
SCHEMBL8369531 0.90 CASP3 (0.51) SMN1; SMN2KMT2AMAPTMEN1TDP1
SCHEMBL8370506 0.90 MAPT (0.51) SMN1; SMN2KMT2AMAPTMEN1TDP1
SCHEMBL8371701 0.87 SMN1; SMN2 (0.45) SMN1; SMN2KMT2AMAPTMEN1TDP1
SCHEMBL8368813 0.87 CDK4 (0.53) SMN1; SMN2KMT2AMAPTMEN1TDP1
SCHEMBL8367237 0.81 MAPT (0.55) SMN1; SMN2KMT2AMAPTMEN1TDP1
SCHEMBL8367064 0.79 CDK4 (0.62) SMN1; SMN2KMT2AMAPTMEN1TDP1
SCHEMBL8541266 0.78 AGTR1 (0.43) SMN1; SMN2KMT2AMAPTMEN1TDP1
SCHEMBL8368653 0.78 MAPT (0.70) SMN1; SMN2KMT2AMAPTMEN1TDP1
SCHEMBL8368659 0.77 MAPT (0.48) SMN1; SMN2KMT2AMAPTMEN1TDP1
SCHEMBL8370509 0.77 CASP3 (0.48) SMN1; SMN2KMT2AMAPTMEN1TDP1

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-1999052365-A1 ANTICANCER AGENTS ELI LILLY AND COMPANY (US) 1999-10-21 WO disclosed