SCHEMBL11520929

SCHEMBL11520929

COc1cccc(Oc2cnc(NC(=O)NC(=O)c3c(Cl)cccc3Cl)cn2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
GHSR Q92847 1/20 0.51
NPC1 O15118 4/20 0.48
KDM4E B2RXH2 4/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPK1 P28482 2/20 0.48
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
EGFR P00533 2/20 0.44
FGFR1 P11362 2/20 0.44
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPK10 P53779 1/20 0.42
HTT P42858 1/20 0.42
BRCA1 P38398 1/20 0.41
HBB P68871 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL11522456 0.92 KDM4E (0.51) MAPTGHSRNPC1KDM4EALDH1A1
SCHEMBL11520937 0.86 MAPT (0.48) MAPTGHSRNPC1KDM4EALDH1A1
SCHEMBL11522459 0.82 MAPT (0.47) MAPTGHSRNPC1KDM4EALDH1A1
SCHEMBL11398748 0.80 NPC1 (0.55) MAPTGHSRNPC1KDM4EALDH1A1
SCHEMBL11527031 0.80 NPC1 (0.41) MAPTGHSRNPC1KDM4EALDH1A1
SCHEMBL11522756 0.77 KDM4E (0.48) MAPTNPC1KDM4EALDH1A1MAPK1
SCHEMBL11523922 0.77 RAF1 (0.43) MAPTNPC1KDM4EALDH1A1MAPK1
SCHEMBL11521872 0.77 KDM4E (0.40) MAPTNPC1KDM4EALDH1A1MAPK1
SCHEMBL11179749 0.76 MAPT (0.52) MAPTGHSRNPC1KDM4EALDH1A1
SCHEMBL11524573 0.76 RAB9A (0.46) MAPTGHSRNPC1MEN1KMT2A

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
US-4160834-A INSECTICIDES ELI LILLY AND COMPANY (US) 1979-07-10 US disclosed
US-4083977-A Novel insecticidal 1-(substituted benzoyl)-3-(substituted pyrazinyl)ureas ELI LILLY AND COMPANY (US) 1978-04-11 US disclosed