SCHEMBL11526152

SCHEMBL11526152

CC(C)(C)c1cnc(NC(=O)NC(=O)c2c(Cl)cccc2Cl)cn1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
TYK2 P29597 6/20 0.41
JAK2 O60674 5/20 0.41
JAK1 P23458 5/20 0.41
KDM4E B2RXH2 3/20 0.41
MAPT P10636 2/20 0.40
GHSR Q92847 1/20 0.40
PPIA P62937 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP3A4 P08684 1/20 0.39
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LCK P06239 1/20 0.38
MAPK14 Q16539 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
SCHEMBL11523665 0.88 HCRTR1 (0.48) RAB9ANPC1TYK2KDM4EMAPT
SCHEMBL11524573 0.83 RAB9A (0.46) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11519411 0.83 RAB9A (0.47) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11520689 0.82 TYK2 (0.42) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11525622 0.82 RAB9A (0.44) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11522976 0.81 RAB9A (0.45) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11519925 0.80 TYK2 (0.46) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11522661 0.80 IL2 (0.42) RAB9ANPC1TYK2JAK2JAK1
SCHEMBL11163699 0.78 RAB9A (0.68) RAB9ANPC1MAPTALDH1A1NPSR1
SCHEMBL11604630 0.78 RAB9A (0.48) RAB9ANPC1TYK2JAK2KDM4E

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