SCHEMBL11524573

SCHEMBL11524573

Cc1cnc(NC(=O)NC(=O)c2c(Cl)cccc2Cl)cn1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TYK2 P29597 8/20 0.44
JAK2 O60674 6/20 0.44
JAK1 P23458 5/20 0.44
CDK9 P50750 1/20 0.43
JAK3 P52333 1/20 0.43
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GHSR Q92847 1/20 0.42
NOTUM Q6P988 1/20 0.42
PPIA P62937 1/20 0.42
CYP3A4 P08684 1/20 0.41
GAA P10253 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
SCHEMBL11519411 0.86 RAB9A (0.47) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11522976 0.84 RAB9A (0.45) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11519925 0.83 TYK2 (0.46) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11526152 0.83 RAB9A (0.42) RAB9ANPC1NPSR1TYK2JAK2
SCHEMBL11522661 0.83 IL2 (0.42) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11520972 0.83 RAB9A (0.45) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11521457 0.82 JAK2 (0.43) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11526321 0.81 STIM1 (0.42) RAB9ANPC1NPSR1TYK2JAK2
SCHEMBL11163699 0.81 RAB9A (0.68) RAB9ANPC1NPSR1MAPTMEN1
SCHEMBL11523665 0.81 HCRTR1 (0.48) RAB9ANPC1NPSR1TYK2MAPT

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